PDB: 245663 件ウェブページステータス検索Chemie searchBIRD

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1YNQ	aldo-keto reductase AKR11C1 from Bacillus halodurans (holo form) 分子名称: GLYCEROL, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, SODIUM ION, ... 著者 Marquardt, T, Kostrewa, D, Winkler, F.K, Li, X.D. 登録日 2005-01-25 公開日 2005-12-06 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.3 Å) 主引用文献 High-resolution Crystal Structure of AKR11C1 from Bacillus halodurans: An NADPH-dependent 4-Hydroxy-2,3-trans-nonenal Reductase J.Mol.Biol., 354, 2005
2QBP	Crystal structure of ptp1b-inhibitor complex 分子名称: 5-(3-{[1-(BENZYLSULFONYL)PIPERIDIN-4-YL]AMINO}PHENYL)-4-BROMO-3-(CARBOXYMETHOXY)THIOPHENE-2-CARBOXYLIC ACID, Tyrosine-protein phosphatase non-receptor type 1 著者 Xu, W. 登録日 2007-06-18 公開日 2008-03-18 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Structure-based optimization of protein tyrosine phosphatase 1B inhibitors: from the active site to the second phosphotyrosine binding site. J.Med.Chem., 50, 2007
3IWO	X-ray crystal structure of the extended-spectrum AmpC Y221G mutant beta-lactamase at 1.90 Angstrom resolution 分子名称: Beta-lactamase, PHOSPHATE ION, beta-D-fructofuranose-(2-1)-alpha-D-glucopyranose 著者 Shoichet, B.K, Thomas, V.L. 登録日 2009-09-03 公開日 2010-02-16 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structural bases for stability-function tradeoffs in antibiotic resistance. J.Mol.Biol., 396, 2010
3PVL	Structure of myosin VIIa MyTH4-FERM-SH3 in complex with the CEN1 of Sans 分子名称: GLYCEROL, Myosin VIIa isoform 1, PHOSPHATE ION, ... 著者 Wu, L, Pan, L.F, Wei, Z.Y, Zhang, M.J. 登録日 2010-12-07 公開日 2011-03-02 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Structure of MyTH4-FERM domains in myosin VIIa tail bound to cargo. Science, 331, 2011
3REO	Monolignol O-methyltransferase (MOMT) 分子名称: (Iso)eugenol O-methyltransferase, 2-methoxy-4-[(1E)-prop-1-en-1-yl]phenol, S-ADENOSYL-L-HOMOCYSTEINE 著者 Bhuiya, M.W, Liu, C.J. 登録日 2011-04-04 公開日 2012-03-14 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Monolignol O-methyltransferase (MOMT) To be Published
4JUD	Crystal Structure of the Ser26Thr mutant of Benzoylformate Decarboxylase from Pseudomonas putida 分子名称: 2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-4-METHYL-2-OXO-2,3-DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE, Benzoylformate decarboxylase, CALCIUM ION, ... 著者 McLeish, M.J, Brodkin, H.R. 登録日 2013-03-24 公開日 2013-04-17 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Crystal Structure of the Ser26Thr mutant of Benzoylformate Decarboxylase from Pseudomonas putida To be Published
1UVC	Lipid Binding in Rice Nonspecific Lipid Transfer Protein-1 Complexes from Oryza sativa 分子名称: NONSPECIFIC LIPID TRANSFER PROTEIN, STEARIC ACID 著者 Cheng, H.-C, Cheng, P.-T, Peng, P, Lyu, P.-C, Sun, Y.-J. 登録日 2004-01-19 公開日 2004-10-19 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Lipid Binding in Rice Nonspecific Lipid Transfer Protein-1 Complexes from Oryza Sativa Protein Sci., 13, 2004
1JIJ	Crystal structure of S. aureus TyrRS in complex with SB-239629 分子名称: [2-AMINO-3-(4-HYDROXY-PHENYL)-PROPIONYLAMINO]-(1,3,4,5-TETRAHYDROXY-4-HYDROXYMETHYL-PIPERIDIN-2-YL)- ACETIC ACID, tyrosyl-tRNA synthetase 著者 Qiu, X, Janson, C.A, Smith, W.W, Jarvest, R.L. 登録日 2001-07-02 公開日 2001-10-26 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (3.2 Å) 主引用文献 Crystal structure of Staphylococcus aureus tyrosyl-tRNA synthetase in complex with a class of potent and specific inhibitors. Protein Sci., 10, 2001
1JQ8	Design of specific inhibitors of phospholipase A2: Crystal structure of a complex formed between phospholipase A2 from Daboia russelli pulchella and a designed pentapeptide Leu-Ala-Ile-Tyr-Ser at 2.0 resolution 分子名称: ACETIC ACID, Peptide inhibitor, Phospholipase A2, ... 著者 Chandra, V, Jasti, J, Kaur, P, Dey, S, Betzel, C, Singh, T.P. 登録日 2001-08-04 公開日 2002-11-06 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Design of specific peptide inhibitors of phospholipase A2: structure of a complex formed between Russell's viper phospholipase A2 and a designed peptide Leu-Ala-Ile-Tyr-Ser (LAIYS). ACTA CRYSTALLOGR.,SECT.D, 58, 2002
2OHR	X-ray crystal structure of beta secretase complexed with compound 6a 分子名称: Beta-secretase 1, DIMETHYL SULFOXIDE, GLYCEROL, ... 著者 Patel, S. 登録日 2007-01-10 公開日 2007-03-13 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2.25 Å) 主引用文献 Application of fragment screening by X-ray crystallography to the discovery of aminopyridines as inhibitors of beta-secretase. J.Med.Chem., 50, 2007
2UWO	Selective and Dual Action Orally Active Inhibitors of Thrombin and Factor Xa 分子名称: (2R)-2-(5-CHLORO-2-THIENYL)-N-{(3S)-1-[(1S)-1-METHYL-2-MORPHOLIN-4-YL-2-OXOETHYL]-2-OXOPYRROLIDIN-3-YL}PROPENE-1-SULFONAMIDE, COAGULATION FACTOR X 著者 Young, R.J, Brown, D, Burns-Kurtis, C.L, Chan, C, Convery, M.A, Hubbard, J.A, Kelly, H.A, Pateman, A.J, Patikis, A, Senger, S, Shah, G.P, Toomey, J.R, Watson, N.S, Zhou, P. 登録日 2007-03-22 公開日 2007-05-08 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 Selective and Dual Action Orally Active Inhibitors of Thrombin and Factor Xa. Bioorg.Med.Chem.Lett., 17, 2007
5OHJ	Human phosphodiesterase 4B catalytic domain in complex with a pyrrolidinyl inhibitor. 分子名称: MAGNESIUM ION, ZINC ION, [(1~{S})-2-[3,5-bis(chloranyl)-1-oxidanyl-pyridin-1-ium-4-yl]-1-[4-[bis(fluoranyl)methoxy]-3-(cyclopropylmethoxy)phenyl]ethyl] (2~{S})-1-[3-(dimethylcarbamoyl)phenyl]sulfonylpyrrolidine-2-carboxylate, ... 著者 Rizzi, A, Carzaniga, L, Armani, E. 登録日 2017-07-17 公開日 2017-12-13 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Discovery and Optimization of Thiazolidinyl and Pyrrolidinyl Derivatives as Inhaled PDE4 Inhibitors for Respiratory Diseases. J. Med. Chem., 60, 2017
3SQQ	CDK2 in complex with inhibitor RC-3-96 分子名称: 1,2-ETHANEDIOL, 4-{[4-amino-5-(2-methylbenzoyl)-1,3-thiazol-2-yl]amino}benzenesulfonamide, Cyclin-dependent kinase 2 著者 Betzi, S, Alam, R, Han, H, Becker, A, Schonbrunn, E. 登録日 2011-07-06 公開日 2012-10-31 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Development of highly potent and selective diaminothiazole inhibitors of cyclin-dependent kinases. J.Med.Chem., 56, 2013
7XJR	MLXase AlXyn26A 分子名称: AlXyn26A 著者 Zhang, Y.Z, Chen, X.L, Zhao, F, Yu, C.M. 登録日 2022-04-18 公開日 2023-04-26 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 A novel class of xylanases specifically degrade marine red algal beta 1,3/1,4-mixed-linkage xylan. J.Biol.Chem., 299, 2023
6K04	Crystal structure of BRD2(BD2)with ligand BY27 bound 分子名称: (6~{R})-~{N}-(4-chlorophenyl)-1-methyl-8-(1-methylpyrazol-4-yl)-5,6-dihydro-4~{H}-[1,2,4]triazolo[4,3-a][1]benzazepin-6-amine, Bromodomain-containing protein 2 著者 Lu, T, Lu, W, Chen, D, Zhao, Y, Luo, C. 登録日 2019-05-05 公開日 2019-09-18 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.251 Å) 主引用文献 Discovery, structural insight, and bioactivities of BY27 as a selective inhibitor of the second bromodomains of BET proteins. Eur.J.Med.Chem., 182, 2019
1GKA	The molecular basis of the coloration mechanism in lobster shell. beta-crustacyanin at 3.2 A resolution 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ASTAXANTHIN, ... 著者 Cianci, M, Rizkallah, P.J, Olczak, A, Raftery, J, Chayen, N.E, Zagalsky, P.F, Helliwell, J.R. 登録日 2001-08-10 公開日 2002-08-08 最終更新日 2024-10-16 実験手法 X-RAY DIFFRACTION (3.23 Å) 主引用文献 The Molecular Basis of the Coloration Mechanism in Lobster Shell: Beta -Crustacyanin at 3.2-A Resolution Proc.Natl.Acad.Sci.USA, 99, 2002
2ZEB	Potent, Nonpeptide Inhibitors of Human Mast Cell Tryptase 分子名称: 1-(1'-{[3-(methylsulfanyl)-2-benzothiophen-1-yl]carbonyl}spiro[1-benzofuran-3,4'-piperidin]-5-yl)methanamine, Tryptase beta 2 著者 Spurlino, J.C, Lewandowski, F, Milligan, C. 登録日 2007-12-08 公開日 2008-12-09 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Potent, nonpeptide inhibitors of human mast cell tryptase. Synthesis and biological evaluation of novel spirocyclic piperidine amide derivatives Bioorg.Med.Chem.Lett., 18, 2008
3R4N	Optimization of Potent, Selective, and Orally Bioavailable Pyrrolodinopyrimidine-containing Inhibitors of Heat Shock Protein 90. Identification of Development Candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1H-pyrazol-1-yl)ethoxy]-6-methylphenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide 分子名称: 4-[2-chloro-6-(4,4,4-trifluorobutoxy)phenyl]-6-methylpyrimidin-2-amine, Heat shock protein HSP 90-alpha 著者 Gajiwala, K.S. 登録日 2011-03-17 公開日 2011-04-27 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Optimization of potent, selective, and orally bioavailable pyrrolodinopyrimidine-containing inhibitors of heat shock protein 90. Identification of development candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1H-pyrazol-1-yl)ethoxy]-6-methylphenyl}-N-(2,2-difluoropropyl)-5,7-dihydro-6H-pyrrolo[3,4-d]pyrimidine-6-carboxamide. J.Med.Chem., 54, 2011
4JHG	Crystal Structure of Medicago truncatula Nodulin 13 (MtN13) in complex with trans-zeatin 分子名称: (2E)-2-methyl-4-(9H-purin-6-ylamino)but-2-en-1-ol, MALONATE ION, MtN13 protein, ... 著者 Ruszkowski, M, Tusnio, K, Ciesielska, A, Brzezinski, K, Dauter, M, Dauter, Z, Sikorski, M, Jaskolski, M. 登録日 2013-03-05 公開日 2013-03-20 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 The landscape of cytokinin binding by a plant nodulin. Acta Crystallogr.,Sect.D, 69, 2013
1BTN	STRUCTURE OF THE BINDING SITE FOR INOSITOL PHOSPHATES IN A PH DOMAIN 分子名称: BETA-SPECTRIN, D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE 著者 Wilmanns, M, Hyvoenen, M, Saraste, M. 登録日 1995-08-23 公開日 1996-03-08 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Structure of the binding site for inositol phosphates in a PH domain. EMBO J., 14, 1995
4DAB	Crystal structure of the hexameric purine nucleoside phosphorylase from Bacillus subtilis in complex with hypoxanthine 分子名称: ACETATE ION, CHLORIDE ION, GLYCEROL, ... 著者 Martins, N.H, Giuseppe, P.O, Meza, A.N, Murakami, M.T. 登録日 2012-01-12 公開日 2012-09-26 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Insights into phosphate cooperativity and influence of substrate modifications on binding and catalysis of hexameric purine nucleoside phosphorylases. Plos One, 7, 2012
2OGA	X-ray crystal structure of S. venezuelae DesV in complex with ketimine intermediate 分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, N-({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)-L-glutamic acid, ... 著者 Holden, H.M, Burgie, E.S. 登録日 2007-01-05 公開日 2007-05-15 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (2.05 Å) 主引用文献 Molecular architecture of DesV from Streptomyces venezuelae: A PLP-dependent transaminase involved in the biosynthesis of the unusual sugar desosamine. Protein Sci., 16, 2007
2ZLA	2-Substituted-16-ene-22-thia-1alpha,25-dihydroxy-26,27-dimethyl-19-norvitamin D3 analogs: Synthesis, biological evaluation and crystal structure 分子名称: (1R,2S,3R,5Z,7E)-17-{(1R)-1-[(2-ethyl-2-hydroxybutyl)sulfanyl]ethyl}-2-(2-hydroxyethoxy)-9,10-secoestra-5,7,16-triene-1,3-diol, Coactivator peptide DRIP, Vitamin D3 receptor 著者 Shimizu, M, Miyamoto, Y, Nakabayashi, M, Masuno, H, Ikura, T, Ito, N. 登録日 2008-04-04 公開日 2008-06-24 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 2-Substituted-16-ene-22-thia-1alpha,25-dihydroxy-26,27-dimethyl-19-norvitamin D3 analogs: Synthesis, biological evaluation, and crystal structure Bioorg.Med.Chem., 16, 2008
1OB0	Kinetic stabilization of Bacillus licheniformis alpha-amylase through introduction of hydrophobic residues at the surface 分子名称: ALPHA-AMYLASE, CALCIUM ION, SODIUM ION 著者 Machius, M, Declerck, N, Huber, R, Wiegand, G. 登録日 2003-01-21 公開日 2003-01-30 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (1.83 Å) 主引用文献 Kinetic Stabilization of Bacillus Licheniformis Alpha-Amylase Through Introduction of Hydrophobic Residues at the Surface J.Biol.Chem., 278, 2003
4DFS	Structure of the catalytic domain of an endo-1,3-beta-glucanase (laminarinase) from Thermotoga petrophila RKU-1 分子名称: CALCIUM ION, Glycoside hydrolase, family 16, ... 著者 Meza, A.N, Ruller, R, Prade, R.A, Squina, F.M, Santos, C.R, Murakami, M.T. 登録日 2012-01-24 公開日 2012-03-14 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (3.754 Å) 主引用文献 Structural studies of an endo-1,3-beta-glucanase from Thermotoga petrophila RKU-1 To be Published

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