PDB: 238582 件ウェブページステータス検索Chemie searchBIRD

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3SA9	Crystal structure of Wild-type HIV-1 protease in complex With AF68 分子名称: ACETATE ION, N~2~-acetyl-N-[(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]-L-isoleucinamide, PHOSPHATE ION, ... 著者 Schiffer, C.A, Nalam, M.N.L. 登録日 2011-06-02 公開日 2012-06-06 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Protease Inhibitors that protrude out from substrate envelope are more susceptible to developing drug resistance To be Published
3SBB	Disulphide-mediated Tetramer of T4 Lysozyme R76C/R80C by Synthetic Symmetrization 分子名称: CHLORIDE ION, Lysozyme 著者 Laganowsky, A, Soriaga, A.B, Zhao, M, Sawaya, M.R, Cascio, D, Yeates, T.O. 登録日 2011-06-03 公開日 2011-09-21 最終更新日 2024-10-16 実験手法 X-RAY DIFFRACTION (1.434 Å) 主引用文献 An approach to crystallizing proteins by metal-mediated synthetic symmetrization. Protein Sci., 20, 2011
4W2R	Structure of Hs/AcPRC2 in complex with 5,8-dichloro-2-[(4-methoxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl]-7-[(R)-methoxy(oxetan-3-yl)methyl]-3,4-dihydroisoquinolin-1(2H)-one 分子名称: 5,8-dichloro-2-[(4-methoxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl]-7-[(R)-methoxy(oxetan-3-yl)methyl]-3,4-dihydroisoquinolin-1(2H)-one, Enhancer of zeste 2 polycomb repressive complex 2 subunit, Polycomb protein EED, ... 著者 Gajiwala, K.S, Brooun, A, Liu, W, Deng, Y, Stewart, A.E. 登録日 2017-09-25 公開日 2017-12-27 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (2.81 Å) 主引用文献 Optimization of Orally Bioavailable Enhancer of Zeste Homolog 2 (EZH2) Inhibitors Using Ligand and Property-Based Design Strategies: Identification of Development Candidate (R)-5,8-Dichloro-7-(methoxy(oxetan-3-yl)methyl)-2-((4-methoxy-6-methyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-3,4-dihydroisoquinolin-1(2H)-one (PF-06821497). J. Med. Chem., 61, 2018
4UTU	Structural and biochemical characterization of the N- acetylmannosamine-6-phosphate 2-epimerase from Clostridium perfringens 分子名称: CHLORIDE ION, N-ACETYLMANNOSAMINE-6-PHOSPHATE 2-EPIMERASE, N-acetylmannosamine-6-phosphate 著者 Pelissier, M.C, Sebban-Kreuzer, C, Guerlesquin, F, Brannigan, J.A, Davies, G.J, Bourne, Y, Vincent, F. 登録日 2014-07-23 公開日 2014-10-15 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Structural and Functional Characterization of the Clostridium Perfringens N-Acetylmannosamine-6-Phosphate 2-Epimerase Essential for the Sialic Acid Salvage Pathway J.Biol.Chem., 289, 2014
4UWM	Type II Baeyer-Villiger monooxygenase.The oxygenating constituent of 3,6-diketocamphane monooxygenase from CAM plasmid of Pseudomonas putida in complex with FMN. 分子名称: 3,6-DIKETOCAMPHANE 1,6 MONOOXYGENASE, DI(HYDROXYETHYL)ETHER, FLAVIN MONONUCLEOTIDE, ... 著者 Isupov, M.N, Schroeder, E, Gibson, R.P, Beecher, J, Donadio, G, Saneei, V, Dcunha, S, McGhie, E.J, Sayer, C, Davenport, C.F, Lau, P.C, Hasegawa, Y, Iwaki, H, Kadow, M, Loschinski, K, Bornscheuer, U.T, Bourenkov, G, Littlechild, J.A. 登録日 2014-08-12 公開日 2015-08-26 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 The Oxygenating Constituent of 3,6-Diketocamphane Monooxygenase from the Cam Plasmid of Pseudomonas Putida: The First Crystal Structure of a Type II Baeyer-Villiger Monooxygenase. Acta Crystallogr.,Sect.D, 71, 2015
3SBW	Crystal structure of the complex between the extracellular domains of mouse PD-1 mutant and human PD-L1 分子名称: Programmed cell death 1 ligand 1, Programmed cell death protein 1 著者 Lazar-Molnar, E, Ramagopal, U.A, Cao, E, Nathenson, S.G, Almo, S.C. 登録日 2011-06-06 公開日 2011-07-13 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2.28 Å) 主引用文献 Crystal structure of the complex between the extracellular domains of mouse PD-1 mutant and human PD-L1 To be published
4UZD	SAR156497 an exquisitely selective inhibitor of Aurora kinases 分子名称: AURORA KINASE A, ethyl (9S)-9-[3-(1H-benzimidazol-2-yloxy)phenyl]-8-oxo-4,5,6,7,8,9-hexahydro-2H-pyrrolo[3,4-b]quinoline-3-carboxylate 著者 Pouzieux, S, Delarbre, L, Crenne, J.Y. 登録日 2014-09-05 公開日 2014-11-19 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (3.2 Å) 主引用文献 Sar156497 an Exquisitely Selective Inhibitor of Aurora Kinases. J.Med.Chem., 58, 2015
4WET	Crystal structure of E.Coli DsbA in complex with compound 16 分子名称: 1,2-ETHANEDIOL, N-({4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl}carbonyl)-L-tyrosine, SODIUM ION, ... 著者 Ilyichova, O.V, Scanlon, M.J. 登録日 2014-09-11 公開日 2015-01-21 最終更新日 2024-10-30 実験手法 X-RAY DIFFRACTION (1.63 Å) 主引用文献 Application of Fragment-Based Screening to the Design of Inhibitors of Escherichia coli DsbA. Angew.Chem.Int.Ed.Engl., 54, 2015
3J78	Structures of yeast 80S ribosome-tRNA complexes in the rotated and non-rotated conformations (Class I - non-rotated ribosome with 2 tRNAs) 分子名称: 18S ribosomal RNA, 25S ribosomal RNA, 40S ribosomal protein S0, ... 著者 Svidritskiy, E, Brilot, A.F, Koh, C.S, Grigorieff, N, Korostelev, A.A. 登録日 2014-05-29 公開日 2014-08-06 最終更新日 2024-02-21 実験手法 ELECTRON MICROSCOPY (6.3 Å) 主引用文献 Structures of Yeast 80S Ribosome-tRNA Complexes in the Rotated and Nonrotated Conformations. Structure, 22, 2014
3SL8	Crystal structure of the catalytic domain of PDE4D2 with compound 10o 分子名称: 1,2-ETHANEDIOL, 3-cyclopentyl 6-ethenyl 2-[(thiophen-2-ylacetyl)amino]-4,7-dihydrothieno[2,3-c]pyridine-3,6(5H)-dicarboxylate, DI(HYDROXYETHYL)ETHER, ... 著者 Feil, S.F. 登録日 2011-06-24 公開日 2011-10-26 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Thiophene inhibitors of PDE4: Crystal structures show a second binding mode at the catalytic domain of PDE4D2. Bioorg.Med.Chem.Lett., 21, 2011
3SLO	Pre-cleavage Structure of the Autotransporter EspP - N1023D mutant 分子名称: (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE, Serine protease espP 著者 Barnard, T.B, Noinaj, N, Easley, N.C, Kuszak, A.J, Buchanan, S.K. 登録日 2011-06-24 公開日 2011-11-16 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.52 Å) 主引用文献 Molecular basis for the activation of a catalytic asparagine residue in a self-cleaving bacterial autotransporter. J.Mol.Biol., 415, 2012
4WFH	Human TRAAK K+ channel in a Tl+ bound nonconductive conformation 分子名称: ANTI-TRAAK ANTIBODY 13E9 FAB FRAGMENT HEAVY CHAIN, ANTI-TRAAK ANTIBODY 13E9 FAB FRAGMENT LIGHT CHAIN, CALCIUM ION, ... 著者 Brohawn, S.G, MacKinnon, R. 登録日 2014-09-15 公開日 2014-12-03 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (3.01 Å) 主引用文献 Physical mechanism for gating and mechanosensitivity of the human TRAAK K+ channel. Nature, 516, 2014
3SCY	Crystal structure of a putative 6-phosphogluconolactonase (BF1038) from Bacteroides fragilis NCTC 9343 at 1.50 A resolution 分子名称: Hypothetical bacterial 6-phosphogluconolactonase, MAGNESIUM ION, SODIUM ION, ... 著者 Joint Center for Structural Genomics (JCSG) 登録日 2011-06-08 公開日 2011-07-20 最終更新日 2024-11-27 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Crystal structure of a Hypothetical bacterial 6-phosphogluconolactonase (BF1038) from Bacteroides fragilis NCTC 9343 at 1.50 A resolution To be published
4WH9	Structure of the CDC25B Phosphatase Catalytic Domain with Bound Inhibitor 分子名称: 2-[(2-cyano-3-fluoro-5-hydroxyphenyl)sulfanyl]ethanesulfonic acid, GLYCEROL, M-phase inducer phosphatase 2, ... 著者 Lund, G.L, Dudkin, S, Borkin, D, Ni, W, Grembecka, J, Cierpicki, T. 登録日 2014-09-20 公開日 2014-12-10 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Inhibition of CDC25B Phosphatase Through Disruption of Protein-Protein Interaction. Acs Chem.Biol., 10, 2015
3SMO	Crystal structure of human 14-3-3 sigma C38V/N166H in complex with TASK-3 peptide and stabilizer Fusicoccin J aglycone 分子名称: 14-3-3 protein sigma, Fusicoccin J aglycone, MAGNESIUM ION, ... 著者 Anders, C, Schumacher, B, Ottmann, C. 登録日 2011-06-28 公開日 2012-07-11 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 A semisynthetic fusicoccane stabilizes a protein-protein interaction and enhances the expression of K+ channels at the cell surface. Chem. Biol., 20, 2013
3SDX	Crystal structure of human autoreactive-Valpha24 NKT TCR in complex with CD1d-beta-galactosylceramide 分子名称: Antigen-presenting glycoprotein CD1d, Beta-2-microglobulin, N-[(2S,3R)-1-(beta-D-galactopyranosyloxy)-3-hydroxyoctadec-4-en-2-yl]tetracosanamide, ... 著者 Clarke, A.J, Patel, O, Rossjohn, J. 登録日 2011-06-09 公開日 2011-10-05 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (3.12 Å) 主引用文献 Recognition of beta-linked self glycolipids mediated by natural killer T cell antigen receptors Nat.Immunol., 12, 2011
4WHZ	Design and Synthesis of Highly Potent and Isoform Selective JNK3 Inhibitors: SAR Studies on Aminopyrazole Derivatives 分子名称: 3-(4-{[(2-chlorophenyl)carbamoyl]amino}-1H-pyrazol-1-yl)-N-{1-[(3S)-pyrrolidin-3-yl]-1H-pyrazol-4-yl}benzamide, Mitogen-activated protein kinase 10 著者 Park, H, LoGrasso, P. 登録日 2014-09-24 公開日 2014-11-26 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.79 Å) 主引用文献 Design and Synthesis of Highly Potent and Isoform Selective JNK3 Inhibitors: SAR Studies on Aminopyrazole Derivatives. J.Med.Chem., 57, 2014
3SN5	Crystal structure of human CYP7A1 in complex with cholest-4-en-3-one 分子名称: (8ALPHA,9BETA)-CHOLEST-4-EN-3-ONE, Cholesterol 7-alpha-monooxygenase, PROTOPORPHYRIN IX CONTAINING FE, ... 著者 Strushkevich, N, Tempel, W, MacKenzie, F, Wernimont, A.K, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Weigelt, J, Park, H, Structural Genomics Consortium (SGC) 登録日 2011-06-28 公開日 2011-07-13 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.75 Å) 主引用文献 Crystal structure of human CYP7A1 in complex with cholest-4-en-3-one To be Published
4WID	Crystal structure of the immediate-early 1 protein (IE1) at 2.31 angstrom (tetragonal form after crystal dehydration) 分子名称: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, RhUL123 著者 Klingl, S, Scherer, M, Sevvana, M, Muller, Y.A, Stamminger, T. 登録日 2014-09-25 公開日 2014-10-29 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (2.31 Å) 主引用文献 Crystal Structure of Cytomegalovirus IE1 Protein Reveals Targeting of TRIM Family Member PML via Coiled-Coil Interactions. Plos Pathog., 10, 2014
4WIV	Crystal Structure of the first bromodomain of human BRD4 in complex with a novel inhibitor UMB32 (N-TERT-BUTYL-2-[4-(3,5-DIMETHYL-1,2-OXAZOL-4-YL) PHENYL]IMIDAZO[1,2-A]PYRAZIN-3-AMINE) 分子名称: 1,2-ETHANEDIOL, Bromodomain-containing protein 4, GLYCEROL, ... 著者 Xu, X, Blacklow, S. 登録日 2014-09-26 公開日 2014-10-29 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.56 Å) 主引用文献 Biased multicomponent reactions to develop novel bromodomain inhibitors. J.Med.Chem., 57, 2014
4WJ3	Crystal structure of the asparagine transamidosome from Pseudomonas aeruginosa 分子名称: 76mer-tRNA, Aspartate--tRNA(Asp/Asn) ligase, Aspartyl/glutamyl-tRNA(Asn/Gln) amidotransferase subunit B, ... 著者 Suzuki, T, Nakamura, A, Kato, K, Tanaka, I, Yao, M. 登録日 2014-09-29 公開日 2014-12-31 最終更新日 2024-10-09 実験手法 X-RAY DIFFRACTION (3.705 Å) 主引用文献 Structure of the Pseudomonas aeruginosa transamidosome reveals unique aspects of bacterial tRNA-dependent asparagine biosynthesis Proc.Natl.Acad.Sci.USA, 112, 2015
4WLA	Time Resolved Serial Femtosecond Crystallography Captures High Resolution Intermediates of PYP 分子名称: 4'-HYDROXYCINNAMIC ACID, Photoactive yellow protein 著者 Tenboer, J, Schmidt, M. 登録日 2014-10-06 公開日 2014-12-17 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Time-resolved serial crystallography captures high-resolution intermediates of photoactive yellow protein. Science, 346, 2014
4WLF	Crystal structure of L-malate bound MDH2 分子名称: (2S)-2-hydroxybutanedioic acid, Malate dehydrogenase, mitochondrial, ... 著者 Eo, Y.M, Han, B.G, Ahn, H.C. 登録日 2014-10-07 公開日 2015-11-25 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Crystal structure of L-malate bound MDH2 To Be Published
3S1L	Crystal Structure of Apo-form FurX 分子名称: HEXAETHYLENE GLYCOL, ZINC ION, Zinc-containing alcohol dehydrogenase superfamily 著者 Hayes, R, Sanchez, E.J, Webb, B.N, Hooper, T, Nissen, M.S, Li, Q, Xun, L. 登録日 2011-05-15 公開日 2012-04-25 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Furfural reduction mechanism of a zinc-dependent alcohol dehydrogenase from Cupriavidus necator JMP134. Mol.Microbiol., 83, 2012
4WLT	High pressure protein crystallography of hen egg white lysozyme at 190 MPa 分子名称: CHLORIDE ION, Lysozyme C, SODIUM ION 著者 Yamada, H, Nagae, T, Watanabe, N. 登録日 2014-10-08 公開日 2015-04-08 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 High-pressure protein crystallography of hen egg-white lysozyme Acta Crystallogr.,Sect.D, 71, 2015

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