PDB: 47065 件ウェブページステータス検索Chemie searchBIRD

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6AX6	The crystal structure of a lysyl hydroxylase from Acanthamoeba polyphaga mimivirus 分子名称: FE (II) ION, IODIDE ION, Procollagen lysyl hydroxylase and glycosyltransferase 著者 Guo, H, Tsai, C, Miller, M.D, Alvarado, S, Tainer, J.A, Phillips Jr, G.N, Kurie, J.M. 登録日 2017-09-06 公開日 2018-02-21 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.241 Å) 主引用文献 Pro-metastatic collagen lysyl hydroxylase dimer assemblies stabilized by Fe2+-binding. Nat Commun, 9, 2018
4Y50	Endothiapepsin in complex with fragment 81 分子名称: 1,2-ETHANEDIOL, 3-(dimethylamino)benzohydrazide, ACETATE ION, ... 著者 Schiebel, J, Heine, A, Klebe, G. 登録日 2015-02-11 公開日 2016-03-02 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.32 Å) 主引用文献 Crystallographic Fragment Screening of an Entire Library To Be Published
2NDL	NMR solution structure of PawS Derived Peptide 22 (PDP-22) 分子名称: PawS derived peptide 著者 Franke, B, Jayasena, A.S, Fisher, M.F, Swedberg, J.E, Taylor, N.L, Mylne, J.S, Rosengren, K. 登録日 2016-07-17 公開日 2016-12-07 最終更新日 2023-06-14 実験手法 SOLUTION NMR 主引用文献 Diverse cyclic seed peptides in the Mexican zinnia (Zinnia haageana). Biopolymers, 106, 2016
2N7L	NMR structure of the N-domain of troponin C bound to the switch region of troponin I and the covalent levosimendan analog i9 分子名称: CALCIUM ION, Troponin C/Troponin I chimera 著者 Pineda Sanabria, S.E, Sykes, B.D, Robertson, I.M. 登録日 2015-09-14 公開日 2016-07-27 最終更新日 2023-06-14 実験手法 SOLUTION NMR 主引用文献 Troponin C with covalently bound levosimendan analog i9 enhances contraction in cardiac muscle fibers To be Published
5U5X	CcP gateless cavity 分子名称: PROTOPORPHYRIN IX CONTAINING FE, Peroxidase, THIOPHENE-3-CARBOXIMIDAMIDE 著者 Fischer, M, Shoichet, B.K. 登録日 2016-12-07 公開日 2017-02-01 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 Testing inhomogeneous solvation theory in structure-based ligand discovery. Proc. Natl. Acad. Sci. U.S.A., 114, 2017
2MPX	Three-dimensional structure of CAP-GLY DOMAIN ASSEMBLED ON MICROTUBULES DETERMINED BY MAS NMR SPECTROSCOPY 分子名称: Dynactin subunit 1 著者 Yan, S, Hou, G, Zhang, H, Polenova, T, Williams, J.C. 登録日 2014-06-08 公開日 2015-11-11 最終更新日 2024-05-15 実験手法 SOLID-STATE NMR 主引用文献 THREE-DIMENSIONAL STRUCTURE of CAP-GLY DOMAIN ASSEMBLED ON MICROTUBULES DETERMINED BY MAS NMR SPECTROSCOPY To be Published
5UHO	Crystal structure of the core catalytic domain of human O-GlcNAcase complexed with PUGNAc 分子名称: O-(2-ACETAMIDO-2-DEOXY D-GLUCOPYRANOSYLIDENE) AMINO-N-PHENYLCARBAMATE, O-GlcNAcase TIM-barrel domain, O-GlcNAcase stalk domain 著者 Klein, D.J, Elsen, N.L. 登録日 2017-01-11 公開日 2017-03-29 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (3.21 Å) 主引用文献 Crystal structure of the core catalytic domain of human O-GlcNAcase and molecular basis of activity and inhibition To Be Published
6B0T	Structural Insights into the Induced-fit Inhibition of Fascin by a Small Molecule 分子名称: 4-methyl-N-(1-{[4-(trifluoromethyl)phenyl]methyl}-1H-indazol-3-yl)-1,2-oxazole-5-carboxamide, Fascin 著者 Dey, R, Huang, X.Y. 登録日 2017-09-15 公開日 2018-04-18 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Structural Insights into the Induced-fit Inhibition of Fascin by a Small-Molecule Inhibitor. J. Mol. Biol., 430, 2018
4Y9X	Crystal structure of glucosyl-3-phosphoglycerate synthase from Mycobacterium tuberculosis in complex with Mn2+, uridine-diphosphate-glucose (UDP-Glc) and phosphoglyceric acid (PGA) - GpgS Mn2+ UDP-Glc PGA-3 分子名称: 1,2-ETHANEDIOL, 3-PHOSPHOGLYCERIC ACID, CHLORIDE ION, ... 著者 Albesa-Jove, D, Rodrigo-Unzueta, A, Cifuente, J.O, Urresti, S, Comino, N, Sancho-Vaello, E, Guerin, M.E. 登録日 2015-02-17 公開日 2015-07-15 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.637 Å) 主引用文献 A Native Ternary Complex Trapped in a Crystal Reveals the Catalytic Mechanism of a Retaining Glycosyltransferase. Angew.Chem.Int.Ed.Engl., 54, 2015
6AVG	Crystal structure of the KFJ37 TCR-NY-ESO-1-HLA-B*07:02 complex 分子名称: ALA-PRO-ARG-GLY-PRO-HIS-GLY-GLY-ALA-ALA-SER-GLY-LEU, Beta-2-microglobulin, HLA class I histocompatibility antigen, ... 著者 Gully, B.S, Gras, S, Rossjohn, J. 登録日 2017-09-02 公開日 2018-02-28 最終更新日 2018-03-28 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Divergent T-cell receptor recognition modes of a HLA-I restricted extended tumour-associated peptide. Nat Commun, 9, 2018
6B2U	Crystal structure of Xanthomonas campestris OleA H285N with Cerulenin 分子名称: (2S, 3R)-3-HYDROXY-4-OXO-7,10-TRANS,TRANS-DODECADIENAMIDE, 3-oxoacyl-[ACP] synthase III, ... 著者 Jensen, M.R, Goblirsch, B.R, Esler, M.A, Christenson, J.K, Mohamed, F.A, Wackett, L.P, Wilmot, C.M. 登録日 2017-09-20 公開日 2018-02-28 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.04 Å) 主引用文献 The role of OleA His285 in substrate coordination of long-chain acyl-CoA To be published
2NCN	Solution Structure of the Autophagy-Related Protein LC3C 分子名称: Autophagy-Related Protein LC3C 著者 Krichel, C, Weiergraeber, O.H, Willbold, D, Neudecker, P. 登録日 2016-04-11 公開日 2017-04-19 最終更新日 2024-05-15 実験手法 SOLUTION NMR 主引用文献 Solution structure of the autophagy-related protein LC3C reveals a polyproline II motif on a mobile tether with phosphorylation site. Sci Rep, 9, 2019
4YTY	Structure of rat xanthine oxidoreductase, C535A/C992R/C1324S, NADH bound form 分子名称: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, BICARBONATE ION, CALCIUM ION, ... 著者 Nishino, T, Okamoto, K, Kawaguchi, Y, Matsumura, T, Eger, B.T, Pai, E.F. 登録日 2015-03-18 公開日 2015-04-22 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 The C-terminal peptide plays a role in the formation of an intermediate form during the transition between xanthine dehydrogenase and xanthine oxidase. Febs J., 282, 2015
2MWH	NMR solution structure of ligand-free OAA 分子名称: Anti-HIV lectin OAA 著者 Lee, D, Carneiro, M.G, Koharudin, L.M, Griesinger, C, Gronenborn, A.M, Ban, D, Sabo, T, Trigo-Mourino, P, Mazur, A. 登録日 2014-11-10 公開日 2015-04-22 最終更新日 2024-05-15 実験手法 SOLUTION NMR 主引用文献 Sampling of Glycan-Bound Conformers by the Anti-HIV Lectin Oscillatoria agardhii agglutinin in the Absence of Sugar. Angew.Chem.Int.Ed.Engl., 54, 2015
5UHL	Crystal structure of the core catalytic domain of human O-GlcNAcase complexed with Thiamet G 分子名称: (2Z,3aR,5R,6S,7R,7aR)-2-(ethylimino)-5-(hydroxymethyl)hexahydro-3aH-pyrano[3,2-d][1,3]thiazole-6,7-diol, O-GlcNAcase TIM-barrel domain, O-GlcNAcase stalk domain 著者 Klein, D.J, Elsen, N.L. 登録日 2017-01-11 公開日 2017-03-29 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (3.14 Å) 主引用文献 Crystal structure of the core catalytic domain of human O-GlcNAcase and molecular basis of activity and inhibition To Be Published
4YCP	E. coli dihydrouridine synthase C (DusC) in complex with tRNATrp 分子名称: FLAVIN MONONUCLEOTIDE, MAGNESIUM ION, SULFATE ION, ... 著者 Byrne, R.T, Jenkins, H.T, Peters, D.T, Whelan, F, Stowell, J, Aziz, N, Kasatsky, P, Rodnina, M.V, Koonin, E.V, Konevega, A.L, Antson, A.A. 登録日 2015-02-20 公開日 2015-04-22 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.55 Å) 主引用文献 Major reorientation of tRNA substrates defines specificity of dihydrouridine synthases. Proc.Natl.Acad.Sci.USA, 112, 2015
5UDF	Structure of the N-terminal domain of lipoprotein-releasing system transmembrane protein LolE from Acinetobacter baumannii 分子名称: Lipoprotein-releasing system transmembrane protein LolE 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2016-12-26 公開日 2017-01-18 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (2.35 Å) 主引用文献 Structure of the N-terminal domain of lipoprotein-releasing system transmembrane protein LolE from Acinetobacter baumannii to be published
6B5T	Structure of PfCSP peptide 29 with human antibody CIS42 分子名称: AMMONIUM ION, CIS42 Fab Heavy chain, CIS42 Fab Light chain, ... 著者 Pancera, M, Weidle, C. 登録日 2017-09-29 公開日 2018-03-21 最終更新日 2018-04-25 実験手法 X-RAY DIFFRACTION (2.222 Å) 主引用文献 A human monoclonal antibody prevents malaria infection by targeting a new site of vulnerability on the parasite. Nat. Med., 24, 2018
4YDG	Crystal structure of compound 10 in complex with HTLV-1 Protease 分子名称: HTLV-1 protease, N,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-AMINO-N-BENZYLBENZENESULFONAMIDE), SULFATE ION 著者 Kuhnert, M, Blum, A, Steuber, H, Diederich, W.E. 登録日 2015-02-22 公開日 2016-02-03 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (3.25 Å) 主引用文献 Privileged Structures Meet Human T-Cell Leukemia Virus-1 (HTLV-1): C2-Symmetric 3,4-Disubstituted Pyrrolidines as Nonpeptidic HTLV-1 Protease Inhibitors. J.Med.Chem., 58, 2015
5UHU	Solution conformation of cytochrome P450 MycG with mycinamicin IV bound 分子名称: MYCINAMICIN IV, Mycinamicin IV hydroxylase/epoxidase, PROTOPORPHYRIN IX CONTAINING FE 著者 Pochapsky, T.C, Tietz, D.R. 登録日 2017-01-12 公開日 2017-08-23 最終更新日 2024-05-01 実験手法 SOLUTION NMR 主引用文献 Solution Conformations and Dynamics of Substrate-Bound Cytochrome P450 MycG. Biochemistry, 56, 2017
5TTB	Solution structure of apo ArCP from yersiniabactin synthetase 分子名称: Siderophore yersiniabactin 著者 Frueh, D.P, Goodrich, A.C. 登録日 2016-11-02 公開日 2017-05-10 最終更新日 2024-05-15 実験手法 SOLUTION NMR 主引用文献 Molecular impact of covalent modifications on nonribosomal peptide synthetase carrier protein communication. J. Biol. Chem., 292, 2017
4Y3R	Endothiapepsin in complex with fragment 306 分子名称: 2-chlorobenzyl carbamimidothioate, ACETATE ION, DIMETHYL SULFOXIDE, ... 著者 Wang, X, Heine, A, Klebe, G. 登録日 2015-02-10 公開日 2016-02-17 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.13 Å) 主引用文献 Crystallographic Fragment Screening of an Entire Library To Be Published
6B7D	Crystal structure of E.coli Phosphopantetheine Adenylyltransferase (PPAT/CoaD) in complex with 3-(4-chlorophenyl)-6-methoxy-4,5-dimethylpyridazine 分子名称: 3-(4-chlorophenyl)-6-methoxy-4,5-dimethylpyridazine, DIMETHYL SULFOXIDE, POTASSIUM ION, ... 著者 Proudfoot, A.W, Bussiere, D, Lingel, A. 登録日 2017-10-03 公開日 2017-12-27 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 High-Confidence Protein-Ligand Complex Modeling by NMR-Guided Docking Enables Early Hit Optimization. J. Am. Chem. Soc., 139, 2017
2N6P	Solution NMR structure of Outer Membrane Protein G P92A mutant from Pseudomonas aeruginosa 分子名称: Outer membrane protein OprG 著者 Kucharska, I, Seelheim, P, Edrington, T.C, Liang, B, Tamm, L.K. 登録日 2015-08-27 公開日 2015-12-30 最終更新日 2024-05-15 実験手法 SOLUTION NMR 主引用文献 OprG Harnesses the Dynamics of its Extracellular Loops to Transport Small Amino Acids across the Outer Membrane of Pseudomonas aeruginosa. Structure, 23, 2015
2NA0	NMR structure of Guanylyl Cyclase Activator Protein 1 (GCAP1) mutant V77E in a Ca2+-free/Mg2+-bound Activator State 分子名称: Guanylyl cyclase-activating protein 1 著者 Lim, S, Ames, J.B. 登録日 2015-12-16 公開日 2015-12-30 最終更新日 2023-06-14 実験手法 SOLUTION NMR 主引用文献 Structure of Guanylyl Cyclase Activator Protein 1 (GCAP1) Mutant V77E in a Ca2+-free/Mg2+-bound Activator State. J.Biol.Chem., 291, 2016

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