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Biochimie 2016 128 20 33 5EJY 27166421 Structure of Dictyostelium Discoideum Myosin VII MyTH4-FERM MF1 domain 2015-11-02 2016-07-06 Planelles-Herrero, V.J.,Blanc, F.,Sirigu, S.,Sirkia, H.,Clause, J.,Sourigues, Y.,Johnsrud, D.O.,Amigues, B.,Cecchini, M.,Gilbert, S.P.,Houdusse, A.,Titus, M.A. Myosin MyTH4-FERM structures highlight important principles of convergent evolution. Proc.Natl.Acad.Sci.USA 2016 113 0 0 5I4O 27356908 Crystal structure of the catalytic domain of MMP-12 in complex with a selective sugar-conjugated triazole-linked carboxylate zinc-chelator water-soluble inhibitor (DC28). 2016-02-12 2016-07-06 Nuti, E.,Cuffaro, D.,D'Andrea, F.,Rosalia, L.,Tepshi, L.,Fabbi, M.,Carbotti, G.,Ferrini, S.,Santamaria, S.,Camodeca, C.,Ciccone, L.,Orlandini, E.,Nencetti, S.,Stura, E.A.,Dive, V.,Rossello, A. Sugar-Based Arylsulfonamide Carboxylates as Selective and Water-Soluble Matrix Metalloproteinase-12 Inhibitors. 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J.Struct.Biol. 2016 195 353 364 5CZM 27996256 Crystal structure of a mutated catalytic domain of Human MMP12 in complex with RXP470 2015-07-31 2016-08-10 Rouanet-Mehouas, C.,Czarny, B.,Beau, F.,Cassar-Lajeunesse, E.,Stura, E.A.,Dive, V.,Devel, L. Zinc-Metalloproteinase Inhibitors: Evaluation of the Complex Role Played by the Zinc-Binding Group on Potency and Selectivity. J. Med. Chem. 2017 60 403 414 5D3C 27996256 Crystal structure of a double mutant catalytic domain of Human MMP12 in complex with an hydroxamate analogue of RXP470 2015-08-06 2016-08-17 Rouanet-Mehouas, C.,Czarny, B.,Beau, F.,Cassar-Lajeunesse, E.,Stura, E.A.,Dive, V.,Devel, L. Zinc-Metalloproteinase Inhibitors: Evaluation of the Complex Role Played by the Zinc-Binding Group on Potency and Selectivity. J. Med. 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Molecular Insights into the Mechanism of Calmodulin Inhibition of the EAG1 Potassium Channel. Structure 2016 24 1742 1754 5HJN 27669036 Crystal structure of the TBC domain of Skywalker/TBC1D24 from Drosophila melanogaster 2016-01-13 2016-09-21 Fischer, B.,Luthy, K.,Paesmans, J.,De Koninck, C.,Maes, I.,Swerts, J.,Kuenen, S.,Uytterhoeven, V.,Verstreken, P.,Versees, W. Skywalker-TBC1D24 has a lipid-binding pocket mutated in epilepsy and required for synaptic function. Nat.Struct.Mol.Biol. 2016 23 965 973 5L9L 27609514 Crystal structure of the PBP MotA from A. tumefaciens B6 in complex with glucopine 2016-06-10 2016-09-21 Marty, L.,Vigouroux, A.,Aumont-Nicaise, M.,Dessaux, Y.,Faure, D.,Morera, S. Structural Basis for High Specificity of Amadori Compound and Mannopine Opine Binding in Bacterial Pathogens. 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Structure and Characterization of a new class I Tagatose-1,6-bipshosphate aldolase from Streptococcus porcinus : switch in specificity directed by an Arginine To Be Published 0 0 0 0 5IUJ 27938660 Crystal structure of the DesK-DesR complex in the phosphotransfer state with low Mg2+ (20 mM) 2016-03-18 2016-12-21 Trajtenberg, F.,Imelio, J.A.,Machado, M.R.,Larrieux, N.,Marti, M.A.,Obal, G.,Mechaly, A.E.,Buschiazzo, A. Regulation of signaling directionality revealed by 3D snapshots of a kinase:regulator complex in action. Elife 2016 5 0 0 5FQN Crystal structure of M. musculus protein arginine methyltransferase PRMT6 with SAH at 1.65 Angstroms 2015-12-14 2017-01-18 Bonnefond, L.,Cura, V.,Troffer-Charlier, N.,Cavarelli, J. 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Nat Commun 2017 8 14937 14937 5FWO 28471361 Llama nanobody PorM_130 2016-02-18 2017-05-03 Duhoo, Y.,Roche, J.,Trinh, T.T.N.,Desmyter, A.,Gaubert, A.,Kellenberger, C.,Cambillau, C.,Roussel, A.,Leone, P. Camelid nanobodies used as crystallization chaperones for different constructs of PorM, a component of the type IX secretion system from Porphyromonas gingivalis. Acta Crystallogr F Struct Biol 2017 73 286 293 5LYC 28407337 Cytochrome c in complex with phosphonato-calix[6]arene 2016-09-27 2017-05-10 Rennie, M.L.,Doolan, A.M.,Raston, C.L.,Crowley, P.B. Protein Dimerization on a Phosphonated Calix[6]arene Disc. Angew. Chem. Int. Ed. Engl. 2017 56 5517 5521 5JRM Crystal Structure of a Xylanase at 1.56 Angstroem resolution 2016-05-06 2017-05-24 Gomez, S.,Payne, A.M.,Savko, M.,Fox, G.C.,Shepard, W.E.,Fernandez, F.J.,Vega, M.C. 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Nat Commun 2017 8 15411 15411 5MKP 28655838 Non redox thiolation in transfer RNAs occuring via sulfur activation by a [4Fe-4S] cluster 2016-12-05 2017-06-14 Arragain, S.,Bimai, O.,Legrand, P.,Caillat, S.,Ravanat, J.L.,Touati, N.,Binet, L.,Atta, M.,Fontecave, M.,Golinelli-Pimpaneau, B. Nonredox thiolation in tRNA occurring via sulfur activation by a [4Fe-4S] cluster. Proc. Natl. Acad. Sci. U.S.A. 2017 114 7355 7360 5K8W Crystal structure of mouse CARM1 in complex with inhibitor U2 2016-05-31 2017-06-21 Cura, V.,Marechal, N.,Mailliot, J.,Troffer-Charlier, N.,Wurtz, J.M.,Bonnefond, L.,Cavarelli, J. Crystal structure of mouse CARM1 in complex with inhibitor U2 To Be Published 0 0 0 0 5L6T CRYSTAL STRUCTURE OF HUMAN CARBONIC ANHYDRASE II IN COMPLEX WITH A QUINOLINE OLIGOAMIDE FOLDAMER 2016-05-31 2017-06-21 Vallade, M.,Fischer, L.,Langlois d'Estaintot, B.,Granier, T.,Huc, I. 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Nature 2017 551 521 524 5M41 29093459 Crystal structure of nigritoxine 2016-10-17 2017-12-06 Labreuche, Y.,Chenivesse, S.,Jeudy, A.,Le Panse, S.,Boulo, V.,Ansquer, D.,Pages, S.,Givaudan, A.,Czjzek, M.,Le Roux, F. Nigritoxin is a bacterial toxin for crustaceans and insects. Nat Commun 2017 8 1248 1248 5OLC 29162826 Crystal structure of the 3,6-anhydro-D-galactonate cycloisomerase from Zobellia galactanivorans 2017-07-27 2017-12-06 Ficko-Blean, E.,Prechoux, A.,Thomas, F.,Rochat, T.,Larocque, R.,Zhu, Y.,Stam, M.,Genicot, S.,Jam, M.,Calteau, A.,Viart, B.,Ropartz, D.,Perez-Pascual, D.,Correc, G.,Matard-Mann, M.,Stubbs, K.A.,Rogniaux, H.,Jeudy, A.,Barbeyron, T.,Medigue, C.,Czjzek, M.,Vallenet, D.,McBride, M.J.,Duchaud, E.,Michel, G. Carrageenan catabolism is encoded by a complex regulon in marine heterotrophic bacteria. 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Chem. 2018 293 3839 3848 5NM6 29248541 Chicken GRIFIN (crystallisation pH: 4.6) 2017-04-05 2018-02-14 Ruiz, F.M.,Gilles, U.,Ludwig, A.K.,Sehad, C.,Shiao, T.C.,Garcia Caballero, G.,Kaltner, H.,Lindner, I.,Roy, R.,Reusch, D.,Romero, A.,Gabius, H.J. Chicken GRIFIN: Structural characterization in crystals and in solution. Biochimie 2018 146 127 138 6F34 29416041 Crystal structure of a bacterial cationic amino acid transporter (CAT) homologue bound to Arginine. 2017-11-27 2018-02-14 Jungnickel, K.E.J.,Parker, J.L.,Newstead, S. Structural basis for amino acid transport by the CAT family of SLC7 transporters. Nat Commun 2018 9 550 550 5MVN 29694907 X-ray structure of the M205W mutant of GLIC in complex with propofol 2017-01-16 2018-02-14 Fourati, Z.,Howard, R.J.,Heusser, S.A.,Hu, H.,Ruza, R.R.,Sauguet, L.,Lindahl, E.,Delarue, M. Structural Basis for a Bimodal Allosteric Mechanism of General Anesthetic Modulation in Pentameric Ligand-Gated Ion Channels. Cell Rep 2018 23 993 1004 5NUE 29194485 Cytosolic Malate Dehydrogenase 1 (peroxide-treated) 2017-04-29 2018-02-28 Huang, J.,Niazi, A.K.,Young, D.,Rosado, L.A.,Vertommen, D.,Bodra, N.,Abdelgawwad, M.R.,Vignols, F.,Wei, B.,Wahni, K.,Bashandy, T.,Bariat, L.,Van Breusegem, F.,Messens, J.,Reichheld, J.P. Self-protection of cytosolic malate dehydrogenase against oxidative stress in Arabidopsis. J. Exp. Bot. 2018 69 3491 3505 5MZQ 29694907 X-ray structure of the M205W mutant of GLIC in complex with bromoform 2017-02-01 2018-02-28 Fourati, Z.,Howard, R.J.,Heusser, S.A.,Hu, H.,Ruza, R.R.,Sauguet, L.,Lindahl, E.,Delarue, M. Structural Basis for a Bimodal Allosteric Mechanism of General Anesthetic Modulation in Pentameric Ligand-Gated Ion Channels. Cell Rep 2018 23 993 1004 5UYR Crystal structure of the dark-adapted full-length bacteriophytochrome XccBphP mutant D199A from Xanthomonas campestris 2017-02-24 2018-02-28 Otero, L.H.,Klinke, S.,Goldbaum, F.A.,Bonomi, H.R. 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RNA 2018 24 1080 1092 6EMV 29848639 Crystal Structure of dual specific Trm10 construct from Thermococcus kodakaraensis. 2017-10-03 2018-06-13 Singh, R.K.,Feller, A.,Roovers, M.,Van Elder, D.,Wauters, L.,Droogmans, L.,Versees, W. Structural and biochemical analysis of the dual-specificity Trm10 enzyme fromThermococcus kodakaraensisprompts reconsideration of its catalytic mechanism. RNA 2018 24 1080 1092 6EMU 29848639 Crystal Structure of dual specific Trm10 construct from Thermococcus kodakaraensis. 2017-10-03 2018-06-13 Singh, R.K.,Feller, A.,Roovers, M.,Van Elder, D.,Wauters, L.,Droogmans, L.,Versees, W. Structural and biochemical analysis of the dual-specificity Trm10 enzyme fromThermococcus kodakaraensisprompts reconsideration of its catalytic mechanism. RNA 2018 24 1080 1092 6EMS 29848639 Crystal Structure of dual specific Trm10 construct from Thermococcus kodakaraensis. 2017-10-03 2018-06-13 Singh, R.K.,Feller, A.,Roovers, M.,Van Elder, D.,Wauters, L.,Droogmans, L.,Versees, W. 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Nat Commun 2018 9 1874 1874 6F5Z 30010922 Complex between the Haloferax volcanii Trm112 methyltransferase activator and the Hvo_0019 putative methyltransferase 2017-12-04 2018-07-11 van Tran, N.,Muller, L.,Ross, R.L.,Lestini, R.,Letoquart, J.,Ulryck, N.,Limbach, P.A.,de Crecy-Lagard, V.,Cianferani, S.,Graille, M. Evolutionary insights into Trm112-methyltransferase holoenzymes involved in translation between archaea and eukaryotes. Nucleic Acids Res. 2018 46 8483 8499 6F8S 30814507 Toxin-Antitoxin complex GraTA 2017-12-13 2018-07-11 Talavera, A.,Tamman, H.,Ainelo, A.,Konijnenberg, A.,Hadzi, S.,Sobott, F.,Garcia-Pino, A.,Horak, R.,Loris, R. A dual role in regulation and toxicity for the disordered N-terminus of the toxin GraT. Nat Commun 2019 10 972 972 6GZP 31098026 Llama nanobody PorM_02 structure determined at room temperature by in-situ diffraction in ChipX microfluidic device 2018-07-04 2018-07-18 de Wijn, R.,Hennig, O.,Roche, J.,Engilberge, S.,Rollet, K.,Fernandez-Millan, P.,Brillet, K.,Betat, H.,Morl, M.,Roussel, A.,Girard, E.,Mueller-Dieckmann, C.,Fox, G.C.,Olieric, V.,Gavira, J.A.,Lorber, B.,Sauter, C. A simple and versatile microfluidic device for efficient biomacromolecule crystallization and structural analysis by serial crystallography. Iucrj 2019 6 454 464 6EP3 30011022 Lar controls the expression of the Listeria monocytogenes agr system and mediates virulence. 2017-10-10 2018-07-25 Pinheiro, J.,Lisboa, J.,Pombinho, R.,Carvalho, F.,Carreaux, A.,Brito, C.,Pontinen, A.,Korkeala, H.,Dos Santos, N.M.S.,Morais-Cabral, J.H.,Sousa, S.,Cabanes, D. MouR controls the expression of the Listeria monocytogenes Agr system and mediates virulence. Nucleic Acids Res. 2018 46 9338 9352 5Z89 30021834 Structural basis for specific inhibition of highly sensitive ShHTL7 receptor 2018-01-31 2018-07-25 Shahul Hameed, U.,Haider, I.,Jamil, M.,Kountche, B.A.,Guo, X.,Zarban, R.A.,Kim, D.,Al-Babili, S.,Arold, S.T. Structural basis for specific inhibition of the highly sensitive ShHTL7 receptor. EMBO Rep. 2018 19 0 0 6EUQ 29530612 MdfA(Q131R/L339E) 2017-10-31 2018-08-08 Zomot, E.,Yardeni, E.H.,Vargiu, A.V.,Tam, H.K.,Malloci, G.,Ramaswamy, V.K.,Perach, M.,Ruggerone, P.,Pos, K.M.,Bibi, E. A New Critical Conformational Determinant of Multidrug Efflux by an MFS Transporter. J. Mol. Biol. 2018 430 1368 1385 6GHD 30137533 Structural analysis of the ternary complex between lamin A/C, BAF and emerin identifies an interface disrupted in autosomal recessive progeroid diseases 2018-05-07 2018-08-08 Samson, C.,Petitalot, A.,Celli, F.,Herrada, I.,Ropars, V.,Le Du, M.H.,Nhiri, N.,Jacquet, E.,Arteni, A.A.,Buendia, B.,Zinn-Justin, S. Structural analysis of the ternary complex between lamin A/C, BAF and emerin identifies an interface disrupted in autosomal recessive progeroid diseases. Nucleic Acids Res. 2018 46 10460 10473 6FD6 29576532 Crystal Structure of Human APRT-Tyr105Phe variant in complex with Adenine, PRPP and Mg2+, 30 days post crystallization (with AMP and PPi products fully generated) 2017-12-21 2018-08-15 Huyet, J.,Ozeir, M.,Burgevin, M.C.,Pinson, B.,Chesney, F.,Remy, J.M.,Siddiqi, A.R.,Lupoli, R.,Pinon, G.,Saint-Marc, C.,Gibert, J.F.,Morales, R.,Ceballos-Picot, I.,Barouki, R.,Daignan-Fornier, B.,Olivier-Bandini, A.,Auge, F.,Nioche, P. Structural Insights into the Forward and Reverse Enzymatic Reactions in Human Adenine Phosphoribosyltransferase. Cell Chem Biol 2018 25 666 6760000 6GXA 29806110 Crystal structure of Schistosoma mansoni HDAC8 complexed with an hydroxamate 2 2018-06-27 2018-08-15 Bayer, T.,Chakrabarti, A.,Lancelot, J.,Shaik, T.B.,Hausmann, K.,Melesina, J.,Schmidtkunz, K.,Marek, M.,Erdmann, F.,Schmidt, M.,Robaa, D.,Romier, C.,Pierce, R.J.,Jung, M.,Sippl, W. Synthesis, Crystallization Studies, and in vitro Characterization of Cinnamic Acid Derivatives as SmHDAC8 Inhibitors for the Treatment of Schistosomiasis. ChemMedChem 2018 13 1517 1529 5ZZW 30134162 Proteobacterial origin of protein arginine methylation and regulation of Complex I assembly by MidA 2018-06-04 2018-08-22 Shahul Hameed, U.F.S.,Sanislav, O.,Lay, S.T.,Annesley, S.J.,Jobichen, C.,Fisher, P.R.,Swaminathan, K.,Arold, S.T. Proteobacterial Origin of Protein Arginine Methylation and Regulation of Complex I Assembly by MidA. Cell Rep 2018 24 1996 2004 6GD9 30109907 Cytochrome c in complex with Sulfonato-calix[8]arene, P43212 form 2018-04-23 2018-08-29 Rennie, M.L.,Fox, G.C.,Perez, J.,Crowley, P.B. Auto-regulated Protein Assembly on a Supramolecular Scaffold. Angew. Chem. Int. Ed. Engl. 2018 57 13764 13769 6GD6 30109907 Cytochrome c in complex with Sulfonato-calix[8]arene, H3 form with ammonium sulfate 2018-04-23 2018-08-29 Rennie, M.L.,Fox, G.C.,Perez, J.,Crowley, P.B. Auto-regulated Protein Assembly on a Supramolecular Scaffold. Angew. Chem. Int. Ed. Engl. 2018 57 13764 13769 6GD8 30109907 Cytochrome c in complex with Sulfonato-calix[8]arene, P31 form 2018-04-23 2018-08-29 Rennie, M.L.,Fox, G.C.,Perez, J.,Crowley, P.B. Auto-regulated Protein Assembly on a Supramolecular Scaffold. Angew. Chem. Int. Ed. Engl. 2018 57 13764 13769 6GD7 30109907 Cytochrome c in complex with Sulfonato-calix[8]arene, H3 form with PEG 2018-04-23 2018-08-29 Rennie, M.L.,Fox, G.C.,Perez, J.,Crowley, P.B. 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Structure of phosphorylated EF-Tu in complex with GTP To Be Published 0 0 0 0 5V5U Crystal structure of leucine-rich protein regulator, ElrR, from Enterococcus faecalis 2017-03-15 2018-09-19 De Groote, M.C.R.,Camargo, I.L.,Repoila, F.,Serror, P.,Horjales, E. Crystal structure of leucine-rich protein regulator, ElrR, from Enterococcus faecalis To be published 0 0 0 0 6F7V 30266997 Crystal structure of LkcE E64Q mutant in complex with LC-KA05 2017-12-12 2018-09-19 Dorival, J.,Risser, F.,Jacob, C.,Collin, S.,Drager, G.,Paris, C.,Chagot, B.,Kirschning, A.,Gruez, A.,Weissman, K.J. Insights into a dual function amide oxidase/macrocyclase from lankacidin biosynthesis. Nat Commun 2018 9 3998 3998 6FJH 30266997 Crystal structure of the seleniated LkcE from Streptomyces rochei 2018-01-22 2018-09-19 Dorival, J.,Risser, F.,Jacob, C.,Collin, S.,Drager, G.,Paris, C.,Chagot, B.,Kirschning, A.,Gruez, A.,Weissman, K.J. Insights into a dual function amide oxidase/macrocyclase from lankacidin biosynthesis. Nat Commun 2018 9 3998 3998 6GQM 30204441 Crystal structure of human c-KIT kinase domain in complex with a small molecule inhibitor, AZD3229 2018-06-07 2018-09-19 Kettle, J.G.,Anjum, R.,Barry, E.,Bhavsar, D.,Brown, C.,Boyd, S.,Campbell, A.,Goldberg, K.,Grondine, M.,Guichard, S.,Hardy, C.J.,Hunt, T.,Jones, R.D.O.,Li, X.,Moleva, O.,Ogg, D.,Overman, R.C.,Packer, M.J.,Pearson, S.,Schimpl, M.,Shao, W.,Smith, A.,Smith, J.M.,Stead, D.,Stokes, S.,Tucker, M.,Ye, Y. Discovery of N-(4-{[5-Fluoro-7-(2-methoxyethoxy)quinazolin-4-yl]amino}phenyl)-2-[4-(propan-2-yl)-1 H-1,2,3-triazol-1-yl]acetamide (AZD3229), a Potent Pan-KIT Mutant Inhibitor for the Treatment of Gastrointestinal Stromal Tumors. J. Med. Chem. 2018 61 8797 8810 6EZA 30149704 Crystal Structure of human tRNA-dihydrouridine(20) synthase catalytic domain E294K mutant 2017-11-14 2018-09-26 Bou-Nader, C.,Bregeon, D.,Pecqueur, L.,Fontecave, M.,Hamdane, D. Electrostatic Potential in the tRNA Binding Evolution of Dihydrouridine Synthases. Biochemistry 2018 57 5407 5414 6EZB 30149704 Crystal Structure of human tRNA-dihydrouridine(20) synthase catalytic domain Q305K mutant 2017-11-14 2018-09-26 Bou-Nader, C.,Bregeon, D.,Pecqueur, L.,Fontecave, M.,Hamdane, D. Electrostatic Potential in the tRNA Binding Evolution of Dihydrouridine Synthases. Biochemistry 2018 57 5407 5414 6EZC 30149704 Crystal Structure of human tRNA-dihydrouridine(20) synthase catalytic domain E294K Q305K double mutant 2017-11-14 2018-09-26 Bou-Nader, C.,Bregeon, D.,Pecqueur, L.,Fontecave, M.,Hamdane, D. Electrostatic Potential in the tRNA Binding Evolution of Dihydrouridine Synthases. Biochemistry 2018 57 5407 5414 6G63 30270108 RNase E in complex with sRNA RrpA 2018-03-31 2018-10-03 Bandyra, K.J.,Wandzik, J.M.,Luisi, B.F. Substrate Recognition and Autoinhibition in the Central Ribonuclease RNase E. Mol. Cell 2018 72 275 2850000 6EI8 31045345 Crystal structure of human tRNA-dihydrouridine (20) synthase dsRBD F359A mutant 2017-09-18 2018-10-10 Bou-Nader, C.,Pecqueur, L.,Barraud, P.,Fontecave, M.,Tisne, C.,Sacquin-Mora, S.,Hamdane, D. Conformational Stability Adaptation of a Double-Stranded RNA-Binding Domain to Transfer RNA Ligand. Biochemistry 2019 58 2463 2473 6EGY 30445810 Crystal structure of cytochrome c in complex with mono-PEGylated sulfonatocalix[4]arene 2017-09-12 2018-10-10 Mummidivarapu, V.V.S.,Rennie, M.L.,Doolan, A.M.,Crowley, P.B. Noncovalent PEGylation via Sulfonatocalix[4]arene-A Crystallographic Proof. Bioconjug.Chem. 2018 29 3999 4003 6ERG 30291363 Complex of XLF and heterodimer Ku bound to DNA 2017-10-18 2018-10-17 Nemoz, C.,Ropars, V.,Frit, P.,Gontier, A.,Drevet, P.,Yu, J.,Guerois, R.,Pitois, A.,Comte, A.,Delteil, C.,Barboule, N.,Legrand, P.,Baconnais, S.,Yin, Y.,Tadi, S.,Barbet-Massin, E.,Berger, I.,Le Cam, E.,Modesti, M.,Rothenberg, E.,Calsou, P.,Charbonnier, J.B. XLF and APLF bind Ku80 at two remote sites to ensure DNA repair by non-homologous end joining. Nat. Struct. Mol. Biol. 2018 25 971 980 6ERH 30291363 Complex of XLF and heterodimer Ku bound to DNA 2017-10-18 2018-10-17 Nemoz, C.,Ropars, V.,Frit, P.,Gontier, A.,Drevet, P.,Yu, J.,Guerois, R.,Pitois, A.,Comte, A.,Delteil, C.,Barboule, N.,Legrand, P.,Baconnais, S.,Yin, Y.,Tadi, S.,Barbet-Massin, E.,Berger, I.,Le Cam, E.,Modesti, M.,Rothenberg, E.,Calsou, P.,Charbonnier, J.B. XLF and APLF bind Ku80 at two remote sites to ensure DNA repair by non-homologous end joining. Nat. Struct. Mol. Biol. 2018 25 971 980 5O5X 30251675 Crystal structure of Thermococcus litoralis ADP-dependent glucokinase (GK) 2017-06-02 2018-10-24 Herrera-Morande, A.,Castro-Fernandez, V.,Merino, F.,Ramirez-Sarmiento, C.A.,Fernandez, F.J.,Vega, M.C.,Guixe, V. Protein topology determines substrate-binding mechanism in homologous enzymes. Biochim Biophys Acta Gen Subj 2018 1862 2869 2878 5O5Y 30251675 Crystal structure of Thermococcus litoralis ADP-dependent glucokinase (GK) 2017-06-02 2018-10-24 Herrera-Morande, A.,Castro-Fernandez, V.,Merino, F.,Ramirez-Sarmiento, C.A.,Fernandez, F.J.,Vega, M.C.,Guixe, V. Protein topology determines substrate-binding mechanism in homologous enzymes. Biochim Biophys Acta Gen Subj 2018 1862 2869 2878 6HTH 30347148 Crystal structure of Schistosoma mansoni HDAC8 complexed with a benzohydroxamate inhibitor 5 2018-10-04 2018-10-31 Marek, M.,Shaik, T.B.,Heimburg, T.,Chakrabarti, A.,Lancelot, J.,Ramos-Morales, E.,Da Veiga, C.,Kalinin, D.,Melesina, J.,Robaa, D.,Schmidtkunz, K.,Suzuki, T.,Holl, R.,Ennifar, E.,Pierce, R.J.,Jung, M.,Sippl, W.,Romier, C. Characterization of Histone Deacetylase 8 (HDAC8) Selective Inhibition Reveals Specific Active Site Structural and Functional Determinants. J. Med. Chem. 2018 61 10000 10016 6ETA 31422822 Crystal Structure of Human Gamma-D crystallin Mutant P23T+R36S at Room Temperature 2017-10-25 2018-11-07 Khan, A.R.,James, S.,Quinn, M.K.,Altan, I.,Charbonneau, P.,McManus, J.J. Temperature-Dependent Interactions Explain Normal and Inverted Solubility in a gamma D-Crystallin Mutant. Biophys.J. 2019 117 930 937 6ETC 31422822 Crystal Structure of Human gamma-D-crystallin Mutant P23T+R36S at 1.2 Angstroms Resolution 2017-10-26 2018-11-07 Khan, A.R.,James, S.,Quinn, M.K.,Altan, I.,Charbonneau, P.,McManus, J.J. Temperature-Dependent Interactions Explain Normal and Inverted Solubility in a gamma D-Crystallin Mutant. Biophys.J. 2019 117 930 937 6EXH 30410048 Crystal structure of the complex Fe(II)/alpha-ketoglutarate dependent dioxygenase KDO5 with Fe(II)/succinate/(4R)-4-hydroxy-L-lysine 2017-11-08 2018-11-14 Bastard, K.,Isabet, T.,Stura, E.A.,Legrand, P.,Zaparucha, A. Structural Studies based on two Lysine Dioxygenases with Distinct Regioselectivity Brings Insights Into Enzyme Specificity within the Clavaminate Synthase-Like Family. Sci Rep 2018 8 16587 16587 6EUO 30410048 Crystal structure of APO Fe(II)/alpha-ketoglutarate dependent dioxygenase KDO5 2017-10-30 2018-11-14 Bastard, K.,Isabet, T.,Stura, E.A.,Legrand, P.,Zaparucha, A. Structural Studies based on two Lysine Dioxygenases with Distinct Regioselectivity Brings Insights Into Enzyme Specificity within the Clavaminate Synthase-Like Family. Sci Rep 2018 8 16587 16587 6BNN 30993890 Crystal structure of V278E-glyoxalase I mutant from Zea mays in space group P4(1)2(1)2 2017-11-17 2018-11-21 Gonzalez, J.M.,Agostini, R.B.,Alvarez, C.E.,Klinke, S.,Andreo, C.S.,Campos-Bermudez, V.A. Deciphering the number and location of active sites in the monomeric glyoxalase I of Zea mays. Febs J. 2019 286 3255 3271 6BNX 30993890 Crystal structure of V278E-glyoxalase I mutant from Zea mays in space group P6(3) 2017-11-17 2018-11-21 Gonzalez, J.M.,Agostini, R.B.,Alvarez, C.E.,Klinke, S.,Andreo, C.S.,Campos-Bermudez, V.A. Deciphering the number and location of active sites in the monomeric glyoxalase I of Zea mays. Febs J. 2019 286 3255 3271 6BNZ 30993890 Crystal structure of E144Q-glyoxalase I mutant from Zea mays in space group P4(1)2(1)2 2017-11-17 2018-11-21 Gonzalez, J.M.,Agostini, R.B.,Alvarez, C.E.,Klinke, S.,Andreo, C.S.,Campos-Bermudez, V.A. Deciphering the number and location of active sites in the monomeric glyoxalase I of Zea mays. Febs J. 2019 286 3255 3271 6EYW Structure of Yeast Myosin 5 Cargo Binding Domain in Trigonal Space Group 2017-11-13 2018-11-21 Tan, J.,Khan, A.R. Structure of yeast myosin V cargo binding domain in a new trigonal space group To Be Published 0 0 0 0 6GHU 30425318 Crystal structure of the periplasmic domain of XcpY, oP crystal form. 2018-05-09 2018-11-21 Fulara, A.,Vandenberghe, I.,Read, R.J.,Devreese, B.,Savvides, S.N. Structure and oligomerization of the periplasmic domain of GspL from the type II secretion system of Pseudomonas aeruginosa. Sci Rep 2018 8 16760 16760 6BN3 CTX-M-151 class A extended-spectrum beta-lactamase apo crystal structure at 1.3 Angstrom resolution 2017-11-16 2018-11-21 Power, P.,Ghiglione, B.,Rodriguez, M.M.,Gutkind, G.,Ishii, Y.,Bonomo, R.A.,Klinke, S. NCTX-M-1 (formerly CTX-M-151) class A extended-spectrum beta-lactamase apo crystal structure at 1.3 Angstrom resolution To Be Published 0 0 0 0 6IPY His-tagged Fyn SH3 domain R96I mutant 2018-11-05 2018-11-28 Arold, S.T.,Aljedani, S.S.,Shahul Hameed, U.F. His-tagged Fyn SH3 domain R96I mutant to be published 0 0 0 0 6IPZ Fyn SH3 domain R96W mutant, crystallized with 18-crown-6 2018-11-05 2018-11-28 Arold, S.T.,Aljedani, S.S.,Shahul Hameed, U.F. Fyn SH3 domain R96W mutant, crystallized with 18-crown-6 to be published 0 0 0 0 6BPF CTX-M-151 class A extended-spectrum beta-lactamase crystal structure in complex with avibactam at 1.32 Angstrom resolution 2017-11-23 2018-11-28 Power, P.,Ghiglione, B.,Rodriguez, M.M.,Gutkind, G.,Ishii, Y.,Bonomo, R.A.,Klinke, S. NCTX-M-1 (formerly CTX-M-151) class A extended-spectrum beta-lactamase crystal structure in complex with avibactam at 1.32 Angstrom resolution To Be Published 0 0 0 0 6G1D 30463959 Corynebacterium glutamicum OxyR C206 mutant 2018-03-21 2018-12-05 Pedre, B.,Young, D.,Charlier, D.,Mourenza, A.,Rosado, L.A.,Marcos-Pascual, L.,Wahni, K.,Martens, E.,G de la Rubia, A.,Belousov, V.V.,Mateos, L.M.,Messens, J. Structural snapshots of OxyR reveal the peroxidatic mechanism of H2O2sensing. Proc. Natl. Acad. Sci. U.S.A. 2018 115 0 0 6EZL Crystal structure of aspartate aminotransferase from Trypanosoma cruzi at 2.07 Angstrom resolution 2017-11-15 2018-12-12 Jagoe, W.N.,Barry, P.J.G.,Nolan, D.P.,Khan, A.R. Structure of aspartate aminotransferase from Trypanosoma Cruzi at 2.07 Angstrom resolution To Be Published 0 0 0 0 6F00 Crystal Structure of human tRNA dihydrouridine synthase (20) dsRBD E423A mutant 2017-11-17 2018-12-12 Charles, B.N.,Djemel, H. Crystal Structure of human tRNA-dihydrouridine(20) synthase dsRBD E423A mutant To Be Published 0 0 0 0 6F37 Fusion protein of RSL and trimeric coiled coil 2017-11-28 2018-12-12 Wronska, M.A.,Rennie, M.L.,Crowley, P.B. Fusion protein of RSL and trimeric coiled coil To Be Published 0 0 0 0 6HYV 30541892 THE GLIC PENTAMERIC LIGAND-GATED ION CHANNEL MUTANT Y119A 2018-10-22 2018-12-19 Hu, H.,Ataka, K.,Menny, A.,Fourati, Z.,Sauguet, L.,Corringer, P.J.,Koehl, P.,Heberle, J.,Delarue, M. 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Shedding X-ray Light on the Role of Magnesium in the Activity ofMycobacterium tuberculosisSalicylate Synthase (MbtI) for Drug Design. J.Med.Chem. 2020 63 7066 7080 6S2T 32393900 Structure of the N-terminal catalytic region of T. thermophilus Rel bound to ppGpp 2019-06-22 2020-07-08 Tamman, H.,Van Nerom, K.,Takada, H.,Vandenberk, N.,Scholl, D.,Polikanov, Y.,Hofkens, J.,Talavera, A.,Hauryliuk, V.,Hendrix, J.,Garcia-Pino, A. A nucleotide-switch mechanism mediates opposing catalytic activities of Rel enzymes. Nat.Chem.Biol. 2020 16 834 840 6S2U 32393900 Structure of the catalytic domain of T. thermophilus Rel in complex with AMP and ppGpp 2019-06-22 2020-07-08 Tamman, H.,Van Nerom, K.,Takada, H.,Vandenberk, N.,Scholl, D.,Polikanov, Y.,Hofkens, J.,Talavera, A.,Hauryliuk, V.,Hendrix, J.,Garcia-Pino, A. A nucleotide-switch mechanism mediates opposing catalytic activities of Rel enzymes. Nat.Chem.Biol. 2020 16 834 840 6HFA 32935897 Crystal structure of hDM2 in complex with a C-terminal triurea capped peptide chimera foldamer. 2018-08-21 2020-07-08 Cussol, L.,Mauran-Ambrosino, L.,Buratto, J.,Belorusova, A.Y.,Neuville, M.,Osz, J.,Fribourg, S.,Fremaux, J.,Dolain, C.,Goudreau, S.R.,Rochel, N.,Guichard, G. Structural Basis for alpha-Helix Mimicry and Inhibition of Protein-Protein Interactions with Oligourea Foldamers. Angew.Chem.Int.Ed.Engl. 2020 0 0 0 6RX9 Crystal structure of TetR from Acinetobacter baumannii AYE 2019-06-07 2020-07-15 Tam, H.K.,Sumyk, M.,Pos, K.M. Crystal structure of TetR from Acinetobacter baumannii AYE To be published 0 0 0 0 6RXB Crystal structure of TetR-Q116A from Acinetobacter baumannii AYE in complex with minocycline 2019-06-07 2020-07-15 Tam, H.K.,Himpich, S.,Pos, K.M. Crystal structure of TetR-Q116A from Acinetobacter baumannii AYE in complex with minocycline To be published 0 0 0 0 6ZA5 32530281 M. tuberculosis salicylate synthase MbtI in complex with salicylate and Mg2+ 2020-06-04 2020-07-15 Mori, M.,Stelitano, G.,Gelain, A.,Pini, E.,Chiarelli, L.R.,Sammartino, J.C.,Poli, G.,Tuccinardi, T.,Beretta, G.,Porta, A.,Bellinzoni, M.,Villa, S.,Meneghetti, F. Shedding X-ray Light on the Role of Magnesium in the Activity ofMycobacterium tuberculosisSalicylate Synthase (MbtI) for Drug Design. J.Med.Chem. 2020 63 7066 7080 6PT7 Structure of KatE1 catalase from Acinetobacter sp. Ver3 2019-07-15 2020-07-22 Gonzalez, J.M.,Sartorio, M.G.,Cortez, N. Structure of KatE1 catalase from Acinetobacter sp. Ver3 To Be Published 0 0 0 0 6XVF 32626661 Crystal structure of bovine cytochrome bc1 in complex with tetrahydro-quinolone inhibitor JAG021 2020-01-21 2020-07-22 McPhillie, M.J.,Zhou, Y.,Hickman, M.R.,Gordon, J.A.,Weber, C.R.,Li, Q.,Lee, P.J.,Amporndanai, K.,Johnson, R.M.,Darby, H.,Woods, S.,Li, Z.H.,Priestley, R.S.,Ristroph, K.D.,Biering, S.B.,El Bissati, K.,Hwang, S.,Hakim, F.E.,Dovgin, S.M.,Lykins, J.D.,Roberts, L.,Hargrave, K.,Cong, H.,Sinai, A.P.,Muench, S.P.,Dubey, J.P.,Prud'homme, R.K.,Lorenzi, H.A.,Biagini, G.A.,Moreno, S.N.,Roberts, C.W.,Antonyuk, S.V.,Fishwick, C.W.G.,McLeod, R. Potent Tetrahydroquinolone Eliminates Apicomplexan Parasites. Front Cell Infect Microbiol 2020 10 203 203 6YPB 32639596 NUDIX1 hydrolase from Rosa x hybrida 2020-04-15 2020-07-22 Sun, P.,Degut, C.,Rety, S.,Caissard, J.C.,Hibrand-Saint Oyant, L.,Bony, A.,Paramita, S.N.,Conart, C.,Magnard, J.L.,Jeauffre, J.,Abd-El-Haliem, A.M.,Marie-Magdelaine, J.,Thouroude, T.,Baltenweck, R.,Tisne, C.,Foucher, F.,Haring, M.,Hugueney, P.,Schuurink, R.C.,Baudino, S. Functional diversification in the Nudix hydrolase gene family drives sesquiterpene biosynthesis in Rosa × wichurana. Plant J. 2020 104 185 199 6XUH 32682158 Crystal structure of human phosphoglucose isomerase in complex with inhibitor 2020-01-20 2020-07-29 Ahmad, L.,Plancqueel, S.,Lazar, N.,Korri-Youssoufi, H.,Li de la Sierra-Gallay, I.,van Tilbeurgh, H.,Salmon, L. Novel N-substituted 5-phosphate-d-arabinonamide derivatives as strong inhibitors of phosphoglucose isomerases: Synthesis, structure-activity relationship and crystallographic studies. Bioorg.Chem. 2020 102 104048 104048 6Z46 32764038 Structure of the S. acidocaldarius 20S proteasome (Saci0613/Saci0662) 2020-05-22 2020-08-05 Tarrason Risa, G.,Hurtig, F.,Bray, S.,Hafner, A.E.,Harker-Kirschneck, L.,Faull, P.,Davis, C.,Papatziamou, D.,Mutavchiev, D.R.,Fan, C.,Meneguello, L.,Arashiro Pulschen, A.,Dey, G.,Culley, S.,Kilkenny, M.,Souza, D.P.,Pellegrini, L.,de Bruin, R.A.M.,Henriques, R.,Snijders, A.P.,Saric, A.,Lindas, A.C.,Robinson, N.P.,Baum, B. The proteasome controls ESCRT-III-mediated cell division in an archaeon. Science 2020 369 0 0 6LD2 32796069 Zika NS5 polymerase domain 2019-11-20 2020-08-12 Gharbi-Ayachi, A.,Santhanakrishnan, S.,Wong, Y.H.,Chan, K.W.K.,Tan, S.T.,Bates, R.W.,Vasudevan, S.G.,El Sahili, A.,Lescar, J. Non-nucleoside Inhibitors of Zika Virus RNA-Dependent RNA Polymerase. J.Virol. 2020 94 0 0 6LD3 32796069 Zika NS5 polymerase domain 2019-11-20 2020-08-19 Gharbi-Ayachi, A.,Santhanakrishnan, S.,Wong, Y.H.,Chan, K.W.K.,Tan, S.T.,Bates, R.W.,Vasudevan, S.G.,El Sahili, A.,Lescar, J. Non-nucleoside Inhibitors of Zika Virus RNA-Dependent RNA Polymerase. J.Virol. 2020 94 0 0 6LD4 32796069 Zika NS5 polymerase domain 2019-11-20 2020-08-19 Gharbi-Ayachi, A.,Santhanakrishnan, S.,Wong, Y.H.,Chan, K.W.K.,Tan, S.T.,Bates, R.W.,Vasudevan, S.G.,El Sahili, A.,Lescar, J. Non-nucleoside Inhibitors of Zika Virus RNA-Dependent RNA Polymerase. J.Virol. 2020 94 0 0 6S99 Dimethylated fusion protein of RSL and trimeric coiled coil in complex with cucurbit[7]uril 2019-07-11 2020-08-26 Ramberg, K.,Engilberge, S.,Wronska, M.A.,Rennie, M.L.,Crowley, P.B. Dimethylated fusion protein of RSL and trimeric coiled coil in complex with cucurbit[7]uril To Be Published 0 0 0 0 6SCY U34-tRNA thiolase NcsA from Methanococcus maripaludis with its [4Fe-4S] cluster 2019-07-25 2020-08-26 Bimai, O.,Legrand, P.,He, N.,Touati, N.,Binet, L.,Fontecave, M.,Golinelli-Pimpaneau, B. The thiolation of uridine 34 in tRNA, which controls protein translation, depends on a [4Fe-4S] cluster in the archeum Methanococcus maripaludis. to be published 0 0 0 0 6U4O Crystal structure of recombinant class II fumarase from Schistosoma mansoni 2019-08-26 2020-09-02 Cardoso, I.A.,Nonato, M.C. Crystal structure of recombinant class II fumarase from Schistosoma mansoni To be published 0 0 0 0 7C2P 32832873 Structure of Egk Peptide 2020-05-08 2020-09-09 Ong, S.T.,Bajaj, S.,Tanner, M.R.,Chang, S.C.,Krishnarjuna, B.,Ng, X.R.,Morales, R.A.V.,Chen, M.W.,Luo, D.,Patel, D.,Yasmin, S.,Ng, J.J.H.,Zhuang, Z.,Nguyen, H.M.,El Sahili, A.,Lescar, J.,Patil, R.,Charman, S.A.,Robins, E.G.,Goggi, J.L.,Tan, P.W.,Sadasivam, P.,Ramasamy, B.,Hartimath, S.V.,Dhawan, V.,Bednenko, J.,Colussi, P.,Wulff, H.,Pennington, M.W.,Kuyucak, S.,Norton, R.S.,Beeton, C.,Chandy, K.G. Modulation of Lymphocyte Potassium Channel KV1.3 by Membrane-Penetrating, Joint-Targeting Immunomodulatory Plant Defensin. Acs Pharmacol Transl Sci 2020 3 720 736 7CJR 32890780 Crystal structure of a periplasmic sensor domain of histidine kinase VbrK 2020-07-12 2020-09-16 Goh, B.C.,Chua, Y.K.,Qian, X.,Lin, J.,Savko, M.,Dedon, P.C.,Lescar, J. Crystal structure of the periplasmic sensor domain of histidine kinase VbrK suggests indirect sensing of beta-lactam antibiotics. J.Struct.Biol. 2020 212 107610 107610 6ZXV Structure of Archaeoglobus fulgidus Trm11 m2G10 tRNA methyltransferase enzyme bound to sinefungin 2020-07-30 2020-09-23 Wang, C.,Tran, N.V.,Jactel, V.,Guerineau, V.,Graille, M. Functional and structural characterization of the Trm11-Trm112 m2G10 tRNA methyltransferase complex Nucleic Acids Res. 2020 0 0 0 6ZXY Structure of Archaeoglobus fulgidus Trm11 m2G10 tRNA methyltransferase enzyme 2020-07-30 2020-09-23 Wang, C.,Tran, N.V.,Jactel, V.,Guerineau, V.,Graille, M. Functional and structural characterization of the Trm11-Trm112 m2G10 tRNA methyltransferase complex Nucleic Acids Res. 0 0 0 0 6TG6 32991829 Toprim domain of RNase M5 2019-11-15 2020-09-23 Oerum, S.,Dendooven, T.,Catala, M.,Gilet, L.,Degut, C.,Trinquier, A.,Bourguet, M.,Barraud, P.,Cianferani, S.,Luisi, B.F.,Condon, C.,Tisne, C. Structures of B. subtilis Maturation RNases Captured on 50S Ribosome with Pre-rRNAs. Mol.Cell 2020 80 227 0 6STH Highly cationic RSL-R8 in complex with sulfonato-calix[8]arene 2019-09-10 2020-09-30 Skorek, T.,Engilberge, S.,Crowley, P.B. Highly cationic RSL-R8 in complex with sulfonato-calix[8]arene To Be Published 0 0 0 0 6Z96 32929873 [4Fe-4S]-dependent thiouracil desulfidase TudS (DUF523Vcz) soaked with 4-thiouracil (12.65 keV, 7.125 keV (Fe-SAD) and 6.5 keV (S-SAD) data) 2020-06-03 2020-09-30 Zhou, J.,Pecqueur, L.,Aucynaite, A.,Fuchs, J.,Rutkiene, R.,Vaitekunas, J.,Meskys, R.,Boll, M.,Fontecave, M.,Urbonavicius, J.,Golinelli-Pimpaneau, B. Structural Evidence for a [4Fe-5S] Intermediate in the Non-Redox Desulfuration of Thiouracil. Angew.Chem.Int.Ed.Engl. 2021 60 424 431 6Z93 32929873 [4Fe-4S]-dependent thiouracil desulfidase TudS (DUF523Vcz) 2020-06-03 2020-09-30 Zhou, J.,Pecqueur, L.,Aucynaite, A.,Fuchs, J.,Rutkiene, R.,Vaitekunas, J.,Meskys, R.,Boll, M.,Fontecave, M.,Urbonavicius, J.,Golinelli-Pimpaneau, B. Structural Evidence for a [4Fe-5S] Intermediate in the Non-Redox Desulfuration of Thiouracil. Angew.Chem.Int.Ed.Engl. 2021 60 424 431 6SW8 32867106 Crystal structure of the NS1 (H7N1) RNA-binding domain 2019-09-20 2020-10-07 Wacquiez, A.,Coste, F.,Kut, E.,Gaudon, V.,Trapp, S.,Castaing, B.,Marc, D. Structure and Sequence Determinants Governing the Interactions of RNAs with Influenza A Virus Non-Structural Protein NS1. Viruses 2020 12 0 0 6SX0 32867106 Specific dsRNA recognition by wild type H7N1 NS1 RNA-binding domain 2019-09-24 2020-10-07 Wacquiez, A.,Coste, F.,Kut, E.,Gaudon, V.,Trapp, S.,Castaing, B.,Marc, D. Structure and Sequence Determinants Governing the Interactions of RNAs with Influenza A Virus Non-Structural Protein NS1. Viruses 2020 12 0 0 6SX2 32867106 dsRNA recognition by R38AK41A mutant of H7N1 NS1 RNA Binding Domain 2019-09-24 2020-10-07 Wacquiez, A.,Coste, F.,Kut, E.,Gaudon, V.,Trapp, S.,Castaing, B.,Marc, D. Structure and Sequence Determinants Governing the Interactions of RNAs with Influenza A Virus Non-Structural Protein NS1. Viruses 2020 12 0 0 6ZLC 32867106 Non-specific dsRNA recognition by wildtype H7N1 RNA-binding domain 2020-06-30 2020-10-07 Wacquiez, A.,Coste, F.,Kut, E.,Gaudon, V.,Trapp, S.,Castaing, B.,Marc, D. Structure and Sequence Determinants Governing the Interactions of RNAs with Influenza A Virus Non-Structural Protein NS1. Viruses 2020 12 0 0 6Y5F 32937107 Crystal structure of the envelope glycoprotein prefusion complex of Andes virus - Mutant H953F 2020-02-25 2020-10-14 Serris, A.,Stass, R.,Bignon, E.A.,Muena, N.A.,Manuguerra, J.C.,Jangra, R.K.,Li, S.,Chandran, K.,Tischler, N.D.,Huiskonen, J.T.,Rey, F.A.,Guardado-Calvo, P. The Hantavirus Surface Glycoprotein Lattice and Its Fusion Control Mechanism. Cell 2020 183 442 0 6Y5W 32937107 Crystal structure of the envelope glycoprotein complex of Andes virus in a near postfusion conformation 2020-02-26 2020-10-14 Serris, A.,Stass, R.,Bignon, E.A.,Muena, N.A.,Manuguerra, J.C.,Jangra, R.K.,Li, S.,Chandran, K.,Tischler, N.D.,Huiskonen, J.T.,Rey, F.A.,Guardado-Calvo, P. The Hantavirus Surface Glycoprotein Lattice and Its Fusion Control Mechanism. Cell 2020 183 442 0 6TI9 32828431 Human transthyretin (TTR) complexed with (E)-3-(((3,5-dibromo-2-hydroxybenzylidene)amino)oxy)propanoic acid. 2019-11-22 2020-10-21 Ciccone, L.,Nencetti, S.,Tonali, N.,Fruchart-Gaillard, C.,Shepard, W.,Nuti, E.,Camodeca, C.,Rossello, A.,Orlandini, E. Monoaryl derivatives as transthyretin fibril formation inhibitors: Design, synthesis, biological evaluation and structural analysis. Bioorg.Med.Chem. 2020 28 115673 115673 6Z7T 33049993 Nucleotide-free Myosin-II motor domain 2020-06-01 2020-10-21 Ewert, W.,Franz, P.,Tsiavaliaris, G.,Preller, M. Structural and Computational Insights into a Blebbistatin-Bound Myosin•ADP Complex with Characteristics of an ADP-Release Conformation along the Two-Step Myosin Power Stoke. Int J Mol Sci 2020 21 0 0 6Z7U 33049993 Myosin-II motor domain complexed with blebbistatin in a new ADP-release conformation 2020-06-01 2020-10-21 Ewert, W.,Franz, P.,Tsiavaliaris, G.,Preller, M. Structural and Computational Insights into a Blebbistatin-Bound Myosin•ADP Complex with Characteristics of an ADP-Release Conformation along the Two-Step Myosin Power Stoke. Int J Mol Sci 2020 21 0 0 7AP2 33081246 Neisseria gonorrhoeae Leucyl-tRNA Synthetase in Complex with Compound LeuS7HMDDA 2020-10-15 2020-10-28 Zhang, B.,Pang, L.,Nautiyal, M.,De Graef, S.,Gadakh, B.,Lescrinier, E.,Rozenski, J.,Strelkov, S.V.,Weeks, S.D.,Van Aerschot, A. Synthesis and Biological Evaluation of 1,3-Dideazapurine-Like 7-Amino-5-Hydroxymethyl-Benzimidazole Ribonucleoside Analogues as Aminoacyl-tRNA Synthetase Inhibitors. Molecules 2020 25 0 0 6VAW 33135679 Peanut lectin complexed with N-beta-D-galactopyranosyl-L-succinamoyl derivative (NGS) 2019-12-18 2020-10-28 Cagnoni, A.J.,Primo, E.D.,Klinke, S.,Cano, M.E.,Giordano, W.,Marino, K.V.,Kovensky, J.,Goldbaum, F.A.,Uhrig, M.L.,Otero, L.H. Crystal structures of peanut lectin in the presence of synthetic beta-N- and beta-S-galactosides disclose evidence for the recognition of different glycomimetic ligands. Acta Crystallogr D Struct Biol 2020 76 1080 1091 6VC3 33135679 Peanut lectin complexed with S-beta-D-thiogalactopyranosyl 6-deoxy-6-S-propynyl-beta-D-glucopyranoside (STG) 2019-12-20 2020-10-28 Cagnoni, A.J.,Primo, E.D.,Klinke, S.,Cano, M.E.,Giordano, W.,Marino, K.V.,Kovensky, J.,Goldbaum, F.A.,Uhrig, M.L.,Otero, L.H. Crystal structures of peanut lectin in the presence of synthetic beta-N- and beta-S-galactosides disclose evidence for the recognition of different glycomimetic ligands. Acta Crystallogr D Struct Biol 2020 76 1080 1091 6VC4 33135679 Peanut lectin complexed with S-beta-D-Thiogalactopyranosyl beta-D-glucopyranoside derivative (STGD) 2019-12-20 2020-10-28 Cagnoni, A.J.,Primo, E.D.,Klinke, S.,Cano, M.E.,Giordano, W.,Marino, K.V.,Kovensky, J.,Goldbaum, F.A.,Uhrig, M.L.,Otero, L.H. Crystal structures of peanut lectin in the presence of synthetic beta-N- and beta-S-galactosides disclose evidence for the recognition of different glycomimetic ligands. Acta Crystallogr D Struct Biol 2020 76 1080 1091 7D7S HIV-1 SF2 Nef in complex with the Fyn SH3 R96I mutant 2020-10-05 2020-11-18 Aldehaiman, A.,Shahul Hamed, U.F.,Arold, S.T. The HIV-1 Nef flexible regions create synergy and allostery for ligand binding to be published 0 0 0 0 6TQS 33124732 The crystal structure of the MSP domain of human MOSPD2 in complex with the conventional FFAT motif of ORP1. 2019-12-17 2020-11-18 Di Mattia, T.,Martinet, A.,Ikhlef, S.,McEwen, A.G.,Nomine, Y.,Wendling, C.,Poussin-Courmontagne, P.,Voilquin, L.,Eberling, P.,Ruffenach, F.,Cavarelli, J.,Slee, J.,Levine, T.P.,Drin, G.,Tomasetto, C.,Alpy, F. FFAT motif phosphorylation controls formation and lipid transfer function of inter-organelle contacts. Embo J. 2020 39 0 0 6TQU 33124732 The crystal structure of the MSP domain of human MOSPD2 in complex with the Phospho-FFAT motif of STARD3. 2019-12-17 2020-11-18 Di Mattia, T.,Martinet, A.,Ikhlef, S.,McEwen, A.G.,Nomine, Y.,Wendling, C.,Poussin-Courmontagne, P.,Voilquin, L.,Eberling, P.,Ruffenach, F.,Cavarelli, J.,Slee, J.,Levine, T.P.,Drin, G.,Tomasetto, C.,Alpy, F. FFAT motif phosphorylation controls formation and lipid transfer function of inter-organelle contacts. Embo J. 2020 39 0 0 6ZK8 32940290 Native crystal structure of anaerobic F420H2-Oxidase from Methanothermococcus thermolithotrophicus at 1.8A resolution 2020-06-30 2020-11-25 Engilberge, S.,Wagner, T.,Carpentier, P.,Girard, E.,Shima, S. Krypton-derivatization highlights O 2 -channeling in a four-electron reducing oxidase. Chem.Commun.(Camb.) 2020 56 10863 10866 6ZUK Crystal structure of dimethylated RSL-N23H/G68H (RSL-B6) in complex with cucurbit[7]uril and zinc 2020-07-23 2020-11-25 Guagnini, F.,Engilberge, S.,Flood, R.J.,Ramberg, K.O.,Crowley, P.B. Metal-Mediated Protein-Cucurbituril Crystalline Architectures Cryst.Growth Des. 2020 0 0 0 6ZUL Crystal structure of dimethylated RSL in complex with cucurbit[7]uril and zinc 2020-07-23 2020-11-25 Guagnini, F.,Engilberge, S.,Flood, R.J.,Ramberg, K.O.,Crowley, P.B. Metal-Mediated Protein-Cucurbituril Crystalline Architectures Cryst.Growth Des. 2020 0 0 0 6ZUM Crystal structure of dimethylated RSL-N23H (RSL-B3) in complex with cucurbit[7]uril and zinc 2020-07-23 2020-11-25 Guagnini, F.,Engilberge, S.,Flood, R.J.,Ramberg, K.O.,Crowley, P.B. Metal-Mediated Protein-Cucurbituril Crystalline Architectures Cryst.Growth Des. 2020 0 0 0 7AZB Structure of DDR2 DS domain in complex with VHH 2020-11-16 2020-11-25 Talagas, A.,Nawrotek, A.,Vuillard, L.M.,Miallau, L. Structure of DDR2 DS domain in complex with VHH To Be Published 0 0 0 0 6YKK 33248851 Neisseria gonorrhoeae Leucyl-tRNA Synthetase in Complex with Compound 15 2020-04-06 2020-12-02 De Ruysscher, D.,Pang, L.,Lenders, S.M.G.,Cappoen, D.,Cos, P.,Rozenski, J.,Strelkov, S.V.,Weeks, S.D.,Van Aerschot, A. Synthesis and structure-activity studies of novel anhydrohexitol-based Leucyl-tRNA synthetase inhibitors. Eur.J.Med.Chem. 2021 211 113021 113021 6YKS 33248851 Neisseria gonorrhoeae Leucyl-tRNA Synthetase in Complex with Compound 11d 2020-04-06 2020-12-02 De Ruysscher, D.,Pang, L.,Lenders, S.M.G.,Cappoen, D.,Cos, P.,Rozenski, J.,Strelkov, S.V.,Weeks, S.D.,Van Aerschot, A. Synthesis and structure-activity studies of novel anhydrohexitol-based Leucyl-tRNA synthetase inhibitors. Eur.J.Med.Chem. 2021 211 113021 113021 6YKW 33248851 Neisseria gonorrhoeae Leucyl-tRNA Synthetase in Complex with Compound 11h 2020-04-06 2020-12-02 De Ruysscher, D.,Pang, L.,Lenders, S.M.G.,Cappoen, D.,Cos, P.,Rozenski, J.,Strelkov, S.V.,Weeks, S.D.,Van Aerschot, A. Synthesis and structure-activity studies of novel anhydrohexitol-based Leucyl-tRNA synthetase inhibitors. Eur.J.Med.Chem. 2021 211 113021 113021 6YKX 33248851 Neisseria gonorrhoeae Leucyl-tRNA Synthetase in Complex with Compound 11j 2020-04-06 2020-12-02 De Ruysscher, D.,Pang, L.,Lenders, S.M.G.,Cappoen, D.,Cos, P.,Rozenski, J.,Strelkov, S.V.,Weeks, S.D.,Van Aerschot, A. Synthesis and structure-activity studies of novel anhydrohexitol-based Leucyl-tRNA synthetase inhibitors. Eur.J.Med.Chem. 2021 211 113021 113021 7A0P 33248851 Neisseria gonorrhoeae Leucyl-tRNA Synthetase in Complex with Compound 11i 2020-08-10 2020-12-02 De Ruysscher, D.,Pang, L.,Lenders, S.M.G.,Cappoen, D.,Cos, P.,Rozenski, J.,Strelkov, S.V.,Weeks, S.D.,Van Aerschot, A. Synthesis and structure-activity studies of novel anhydrohexitol-based Leucyl-tRNA synthetase inhibitors. Eur.J.Med.Chem. 2021 211 113021 113021 6TJN Human transthyretin (TTR) complexed with (E)-3-(((4-hydroxybenzylidene)amino)oxy)propanoic acid 2019-11-26 2020-12-16 Ciccone, L.,Nencetti, S.,Orlandini, E.,Rossello, A.,Shepard, W. Human transthyretin (TTR) complexed with (E)-3-(((4-hydroxybenzylidene)amino)oxy)propanoic acid To Be Published 0 0 0 0 6TNH Deoxyguanylosuccinate synthase (DgsS) quaternary structure with AMPPcP, dGMP, Asp, Magnesium at 2.21 Angstrom resolution 2019-12-08 2020-12-16 Sleiman, D.,Loc'h, J.,Haouz, A.,Kaminski, P.A. Deoxyguanylosuccinate synthase (DgsS) quaternary structure with AMPPcP, dGMP, Asp, Magnesium at 2.21 Angstrom resolution To Be Published 0 0 0 0 7AYM Structure of DDR2 Kinase domain in complex with IBZ3 2020-11-12 2020-12-16 Nawrotek, A.,Talagas, A.,Vuillard, L.M.,Miallau, L. Structure of DDR2 Kinase domain in complex with IBZ3 To Be Published 0 0 0 0 6Y7P The complex between the eight-bladed symmetrical designer protein Tako8 and 1:2 zirconium(IV) Wells-Dawson (ZrWD) 2020-03-02 2020-12-16 Vandebroek, L.,Noguchi, H.,Kamata, K.,Tame, J.R.H.,Parac-Vogt, T.N.,Voet, A.R.D. Shape and Size Complementarity-Induced Formation of Supramolecular Protein Assemblies with Metal-Oxo Clusters Cryst.Growth Des. 2021 0 0 0 6TRV Structure of SapL1 lectin in complex with alpha methyl fucoside 2019-12-19 2020-12-23 Martinez Alarcon, D.,Pieters, R.J.,Varrot, A. Structure and specificity of SapL1: a Target for the Development of Antiadhesive Therapy Against Scedosporium apiospermum. To Be Published 0 0 0 0 7A17 33349335 Crystal structure of the 5-phosphatase domain of Synaptojanin1 bound to its substrate diC8-PI(3,4,5)P3 in complex with a nanobody 2020-08-12 2020-12-30 Paesmans, J.,Martin, E.,Deckers, B.,Berghmans, M.,Sethi, R.,Loeys, Y.,Pardon, E.,Steyaert, J.,Verstreken, P.,Galicia, C.,Versees, W. A structure of substrate-bound Synaptojanin1 provides new insights in its mechanism and the effect of disease mutations. Elife 2020 9 0 0 6PH3 LOV-PAS construct from the LOV-HK sensory protein from Brucella abortus (dark-adapted, construct 15-273) 2019-06-25 2020-12-30 Rinaldi, J. Asymmetric rearrangement triggers the activation of the Brucella homodimeric blue light sensor histidine kinase LOV-HK To be published 0 0 0 0 6PH4 Full length LOV-PAS-HK construct from the LOV-HK sensory protein from Brucella abortus (light-adapted, construct 15-489) 2019-06-25 2020-12-30 Rinaldi, J. Asymmetric rearrangement triggers the activation of the Brucella homodimeric blue light sensor histidine kinase LOV-HK To be published 0 0 0 0 6Y3G 32680846 Crystal structure of phenylalanine tRNA from Escherichia coli 2020-02-18 2020-12-30 Bourgeois, G.,Seguin, J.,Babin, M.,Gondry, M.,Mechulam, Y.,Schmitt, E. Structural basis of the interaction between cyclodipeptide synthases and aminoacylated tRNA substrates. Rna 2020 26 1589 1602 6Y4B 32680846 Structure of cyclodipeptide synthase from Candidatus Glomeribacter gigasporarum bound to Phe-tRNAPhe 2020-02-20 2020-12-30 Bourgeois, G.,Seguin, J.,Babin, M.,Gondry, M.,Mechulam, Y.,Schmitt, E. Structural basis of the interaction between cyclodipeptide synthases and aminoacylated tRNA substrates. Rna 2020 26 1589 1602 7B19 33374308 Mutant Myosin-II-GGG motor domain 2020-11-24 2021-01-13 Franz, P.,Ewert, W.,Preller, M.,Tsiavaliaris, G. Unraveling a Force-Generating Allosteric Pathway of Actomyosin Communication Associated with ADP and P i Release. Int J Mol Sci 2020 22 0 0 7AIJ 33356231 HIV-1 REVERSE TRANSCRIPTASE COMPLEX WITH DNA AND L-METHIONINE TENOFOVIR 2020-09-27 2021-01-13 Gu, W.,Martinez, S.,Nguyen, H.,Xu, H.,Herdewijn, P.,De Jonghe, S.,Das, K. Tenofovir-Amino Acid Conjugates Act as Polymerase Substrates-Implications for Avoiding Cellular Phosphorylation in the Discovery of Nucleotide Analogues. J.Med.Chem. 2021 64 782 796 6TIU 33544140 DROSOPHILA GTP-TUBULIN Y222F MUTANT 2019-11-22 2021-01-27 Ayukawa, R.,Iwata, S.,Imai, H.,Kamimura, S.,Hayashi, M.,Ngo, K.X.,Minoura, I.,Uchimura, S.,Makino, T.,Shirouzu, M.,Shigematsu, H.,Sekimoto, K.,Gigant, B.,Muto, E. GTP-dependent formation of straight tubulin oligomers leads to microtubule nucleation. J.Cell Biol. 2021 220 0 0 6TIZ 33544140 DROSOPHILA GDP-TUBULIN Y222F MUTANT 2019-11-22 2021-01-27 Ayukawa, R.,Iwata, S.,Imai, H.,Kamimura, S.,Hayashi, M.,Ngo, K.X.,Minoura, I.,Uchimura, S.,Makino, T.,Shirouzu, M.,Shigematsu, H.,Sekimoto, K.,Gigant, B.,Muto, E. GTP-dependent formation of straight tubulin oligomers leads to microtubule nucleation. J.Cell Biol. 2021 220 0 0 7A3Z 33513284 OSM-3 kinesin motor domain complexed with Mg.ADP 2020-08-19 2021-02-03 Varela, P.F.,Chenon, M.,Velours, C.,Verhey, K.J.,Menetrey, J.,Gigant, B. Structural snapshots of the kinesin-2 OSM-3 along its nucleotide cycle: implications for the ATP hydrolysis mechanism. Febs Open Bio 2021 0 0 0 7D5D 33503265 Left-handed G-quadruplex containing one bulge 2020-09-25 2021-02-10 Das, P.,Ngo, K.H.,Winnerdy, F.R.,Maity, A.,Bakalar, B.,Mechulam, Y.,Schmitt, E.,Phan, A.T. Bulges in left-handed G-quadruplexes. Nucleic Acids Res. 2021 49 1724 1736 7BFO 33513869 Thermogutta terrifontis esterase 2 phosphonylated by VX 2021-01-04 2021-02-10 Bzdrenga, J.,Trenet, E.,Chantegreil, F.,Bernal, K.,Nachon, F.,Brazzolotto, X. A Thermophilic Bacterial Esterase for Scavenging Nerve Agents: A Kinetic, Biophysical and Structural Study. Molecules 2021 26 0 0 7BFR 33513869 Thermogutta terrifontis esterase 2 phosphorylated by paraoxon 2021-01-04 2021-02-10 Bzdrenga, J.,Trenet, E.,Chantegreil, F.,Bernal, K.,Nachon, F.,Brazzolotto, X. A Thermophilic Bacterial Esterase for Scavenging Nerve Agents: A Kinetic, Biophysical and Structural Study. Molecules 2021 26 0 0 7BFT 33513869 Thermogutta terrifontis esterase 2 phosphoramylated by tabun 2021-01-04 2021-02-10 Bzdrenga, J.,Trenet, E.,Chantegreil, F.,Bernal, K.,Nachon, F.,Brazzolotto, X. A Thermophilic Bacterial Esterase for Scavenging Nerve Agents: A Kinetic, Biophysical and Structural Study. Molecules 2021 26 0 0 7BFU 33513869 Thermogutta terrifontis esterase 2 phosphonylated by sarin 2021-01-04 2021-02-10 Bzdrenga, J.,Trenet, E.,Chantegreil, F.,Bernal, K.,Nachon, F.,Brazzolotto, X. A Thermophilic Bacterial Esterase for Scavenging Nerve Agents: A Kinetic, Biophysical and Structural Study. Molecules 2021 26 0 0 6Y0J Cytochrome c in complex with phosphonato-calix[6]arene and sulfonato-calix[8]arene 2020-02-07 2021-02-17 Engilberge, S.,Rennie, M.L.,Crowley, P.B. Cytochrome c in complex with phosphonato-calix[6]arene and sulfonato-calix[8]arene To Be Published 0 0 0 0 7A7P 33543524 rsGreen0.7-K206A partially in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A7Q 33543524 rsGreenF-K206A in the green-on state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A7R 33543524 rsGreenF-K206A in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A7S 33543524 rsGreenF in the green-on state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A7T 33543524 rsGreenF partially in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A7U 33543524 rsGreen1 in the green-on state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A7V 33543524 rsGreen1-K206A partially in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A7X 33543524 rsGreen0.7-F145M in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A82 33543524 rsGreen0.7-K206A-F145A partially in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A83 33543524 rsGreen0.7-K206A-F145H in the green-on-state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A84 33543524 rsGreen0.7-K206A-F145H partially in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A86 33543524 rsGreen0.7-K206A-F145L partially in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A89 33543524 rsGreen0.7-K206A-F145Q in the green-on state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A8A 33543524 rsGreen0.7-K206A-F145Q partially in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A8C 33543524 rsGreen0.7-K206A-F145S in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A8F 33543524 rsGreen0.7-K206A-F165L in the green-on state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A8G 33543524 rsGreen0.7-K206A-H148G in the green-on state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A8H 33543524 rsGreen0.7-K206A-H148S in the green-on state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A8I 33543524 rsGreen0.7-K206A-H148S partially in the green-off state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 7A8N 33543524 rsGreen0.7-K206A-N205L in the green-on state 2020-08-30 2021-02-17 De Zitter, E.,Hugelier, S.,Duwe, S.,Vandenberg, W.,Tebo, A.G.,Van Meervelt, L.,Dedecker, P. Structure-Function Dataset Reveals Environment Effects within a Fluorescent Protein Model System. Angew.Chem.Int.Ed.Engl. 2021 0 0 0 6YAY 33563593 Crystal structure of a Selenium-derivatized complex of the bacterial cellulose secretion regulators BcsR and BcsQ, crystallized in the presence of ADP 2020-03-14 2021-02-24 Abidi, W.,Zouhir, S.,Caleechurn, M.,Roche, S.,Krasteva, P.V. Architecture and regulation of an enterobacterial cellulose secretion system. Sci Adv 2021 7 0 0 6YB5 33563593 Orthorhombic crystal structure of a native BcsRQ complex crystallized in the presence of ADP 2020-03-15 2021-02-24 Abidi, W.,Zouhir, S.,Caleechurn, M.,Roche, S.,Krasteva, P.V. Architecture and regulation of an enterobacterial cellulose secretion system. Sci Adv 2021 7 0 0 6YBB 33563593 Crystal structure of a native BcsE (217-523) - BcsR-BcsQ (R156E mutant) complex with c-di-GMP and ATP bound 2020-03-16 2021-02-24 Abidi, W.,Zouhir, S.,Caleechurn, M.,Roche, S.,Krasteva, P.V. Architecture and regulation of an enterobacterial cellulose secretion system. Sci Adv 2021 7 0 0 6YBU 33563593 Crystal structure of a native BcsE (349-523) RQ complex with c-di-GMP and ATP bound 2020-03-17 2021-02-24 Abidi, W.,Zouhir, S.,Caleechurn, M.,Roche, S.,Krasteva, P.V. Architecture and regulation of an enterobacterial cellulose secretion system. Sci Adv 2021 7 0 0 6ZXR Crystal structure of the KDEL receptor bound to RDEL peptide at pH 6.0 2020-07-30 2021-02-24 Braeuer, P.,Gerondopoulos, A.,Wu, Z.,Parker, J.L.,Biggin, P.C.,Barr, F.A.,Newstead, S. Signal discrimination by the KDEL receptor ensures efficient retention of high and low abundance ER proteins. To Be Published 0 0 0 0 6YSY 33035452 Skeletal Myosin bound to MPH-220, MgADP-VO4 2020-04-23 2021-03-03 Gyimesi, M.,Horvath, A.I.,Turos, D.,Suthar, S.K.,Penzes, M.,Kurdi, C.,Canon, L.,Kikuti, C.,Ruppel, K.M.,Trivedi, D.V.,Spudich, J.A.,Lorincz, I.,Rauscher, A.A.,Kovacs, M.,Pal, E.,Komoly, S.,Houdusse, A.,Malnasi-Csizmadia, A. Single Residue Variation in Skeletal Muscle Myosin Enables Direct and Selective Drug Targeting for Spasticity and Muscle Stiffness. Cell 2020 183 335 2147483647 6ZP9 Cyanophage S-2L Primase-Polymerase (PrimPol), AEP domain (PP-N190) 2020-07-08 2021-03-03 Czernecki, D.,Legrand, P.,Tekpinar, M.,Rosario, S.,Kaminski, P.A.,Delarue, M. How cyanophage S-2L rejects adenine and incorporates 2-aminoadenine to saturate hydrogen bonding in its DNA Nat Commun 2021 0 0 0 6ZPA Cyanophage S-2L HD phosphohydrolase (DatZ) bound to dA and one catalytic Zn2+ ion 2020-07-08 2021-03-03 Czernecki, D.,Legrand, P.,Tekpinar, M.,Rosario, S.,Kaminski, P.A.,Delarue, M. How cyanophage S-2L rejects adenine and incorporates 2-aminoadenine to saturate hydrogen bonding in its DNA Nat Commun 2021 0 0 0 6ZPC Cyanophage S-2L HD phosphohydrolase (DatZ) bound to dATP 2020-07-08 2021-03-03 Czernecki, D.,Legrand, P.,Tekpinar, M.,Rosario, S.,Kaminski, P.A.,Delarue, M. How cyanophage S-2L rejects adenine and incorporates 2-aminoadenine to saturate hydrogen bonding in its DNA Nat Commun 2021 0 0 0 7AW2 MerTK kinase domain with type 1.5 inhibitor from a DNA-encoded library 2020-11-06 2021-03-03 Nissink, J.W.M.,Blackett, C.,Clarke, M.,Disch, J.,Goldberg, K.,Guilinger, J.,Hennessy, E.J.,Jetson, R.,Ginkunja, D.,Hardaker, E.,Keefe, A.,McCoull, W.,McMurray, L.,Collingwood, O.,Overman, R.,Pflug, A.,Preston, M.,Rawlins, P.,Rivers, E.,Schimpl, M.,Smith, P.,Underwood, E.,Truman, C.,Warwicker, J.,Winter, J.,Woodcock, S.,Zhang, Y. Generating selective leads for Mer kinase inhibitors - example of a comprehensive lead-generation strategy J.Med.Chem. 2021 0 0 0