PDB: 4050 件ウェブページステータス検索Chemie searchBIRD

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3RXV	Crystal structure of Trypsin complexed with benzamide (F05 and F03, cocktail experiment) 分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Zhou, Y, Tanaka, I. 登録日 2011-05-10 公開日 2011-08-24 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXS	Crystal structure of Trypsin complexed with (3-methoxyphenyl)methanamine (F04 and A06, cocktail experiment) 分子名称: 1-(3-methoxyphenyl)methanamine, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Zhou, Y, Tanaka, I. 登録日 2011-05-10 公開日 2011-08-24 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.74 Å) 主引用文献 In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXE	Crystal structure of Trypsin complexed with benzamide 分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Zhou, Y, Tanaka, I. 登録日 2011-05-10 公開日 2011-08-24 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3RXR	Crystal structure of Trypsin complexed with cycloheptanamine (F01 and F03, cocktail experiment) 分子名称: CALCIUM ION, Cationic trypsin, DIMETHYL SULFOXIDE, ... 著者 Yamane, J, Yao, M, Zhou, Y, Tanaka, I. 登録日 2011-05-10 公開日 2011-08-24 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.72 Å) 主引用文献 In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3ATL	Crystal structure of trypsin complexed with benzamidine 分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Tanaka, I. 登録日 2011-01-05 公開日 2011-08-24 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.74 Å) 主引用文献 In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3ATK	Crystal structure of trypsin complexed with cycloheptanamine 分子名称: CALCIUM ION, Cationic trypsin, DIMETHYL SULFOXIDE, ... 著者 Yamane, J, Yao, M, Tanaka, I. 登録日 2011-01-05 公開日 2011-08-24 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.74 Å) 主引用文献 In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3ATI	Crystal structure of trypsin complexed with (3-methoxyphenyl)methanamine 分子名称: 1-(3-methoxyphenyl)methanamine, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Tanaka, I. 登録日 2011-01-05 公開日 2011-08-24 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.71 Å) 主引用文献 In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3ATM	Crystal structure of trypsin complexed with 2-(1H-indol-3-yl)ethanamine 分子名称: 2-(1H-INDOL-3-YL)ETHANAMINE, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Tanaka, I. 登録日 2011-01-05 公開日 2011-08-24 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.72 Å) 主引用文献 In-crystal affinity ranking of fragment hit compounds reveals a relationship with their inhibitory activities J.Appl.Crystallogr., 44, 2011
3QK1	Crystal Structure of Enterokinase-like Trypsin Variant 分子名称: 1,2-ETHANEDIOL, BENZAMIDINE, CALCIUM ION, ... 著者 Schoepfel, M, Tziridis, A, Arnold, U, Stubbs, M.T. 登録日 2011-01-31 公開日 2011-03-23 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.08 Å) 主引用文献 Towards a restriction proteinase: construction of a self-activating enzyme. Chembiochem, 12, 2011
2FX4	Bovine trypsin bound by 4-piperidinebutyrate to make acylenzyme complex 分子名称: 4-PIPERIDINEBUTYRATE, CALCIUM ION, trypsin 著者 Katz, B.A. 登録日 2006-02-03 公開日 2006-02-14 最終更新日 2017-10-18 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Structure-guided design of Peptide-based tryptase inhibitors. Biochemistry, 45, 2006
2G8T	Indole-amidine Complexes with Bovine Trypsin 分子名称: 2-(2-METHYLPHENYL)-1H-INDOLE-5-CARBOXIMIDAMIDE, CALCIUM ION, Cationic trypsin, ... 著者 Kline, A.D, Briggs, S.L, Subramaniam, S. 登録日 2006-03-03 公開日 2006-09-05 最終更新日 2011-07-13 実験手法 X-RAY DIFFRACTION (1.41 Å) 主引用文献 Ligand Epitoping By Proton NMR Chemical Shift Differences To be published
2FX6	bovine trypsin complexed with 2-aminobenzamidazole 分子名称: 2H-BENZOIMIDAZOL-2-YLAMINE, CALCIUM ION, Trypsin 著者 Katz, B.A. 登録日 2006-02-03 公開日 2006-02-14 最終更新日 2017-10-18 実験手法 X-RAY DIFFRACTION (1.57 Å) 主引用文献 Structure-guided design of Peptide-based tryptase inhibitors. Biochemistry, 45, 2006
2G5N	Indole-amidine Complexes with Bovine Trypsin 分子名称: 2-(3-METHYLPHENYL)-1H-INDOLE-5-CARBOXIMIDAMIDE, CALCIUM ION, Cationic trypsin, ... 著者 Kline, A.D, Briggs, S.L, Subramaniam, S. 登録日 2006-02-23 公開日 2006-08-29 最終更新日 2011-07-13 実験手法 X-RAY DIFFRACTION (1.51 Å) 主引用文献 Ligand Epitoping By Proton NMR Chemical Shift Differences To be published
2G5V	Indole-amidine Complexes with Bovine Trypsin 分子名称: 2-(2-METHYLPHENYL)-1H-INDOLE-6-CARBOXIMIDAMIDE, CALCIUM ION, Cationic trypsin 著者 Kline, A.D, Briggs, S.L, Subramaniam, S. 登録日 2006-02-23 公開日 2006-08-29 最終更新日 2011-07-13 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Ligand Epitoping By Proton NMR Chemical Shift Differences To be published
6T9U	Bovine Trypsine in complex with the synthetic inhibitor (S)-3'-(N-(1-(4-(3-(tert-butyl)ureido)piperidin-1-yl)-3-(3-carbamimidoylphenyl)-1-oxopropan-2-yl)sulfamoyl)-[1,1'-biphenyl]-3-carboximidamide (MI-490) 分子名称: 1-~{tert}-butyl-3-[1-[(2~{S})-3-(3-carbamimidoylphenyl)-2-[[3-(3-carbamimidoylphenyl)phenyl]sulfonylamino]propanoyl]piperidin-4-yl]urea, CALCIUM ION, Cationic Trypsin, ... 著者 Mueller, J.M, Merkl, S, Keils, A, Pilgram, O, Steinmetzer, T. 登録日 2019-10-28 公開日 2020-11-18 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.067509 Å) 主引用文献 Improving the selectivity of 3-amidinophenylalanine-derived matriptase inhibitors Eur.J.Med.Chem., 2022
2G55	Anomalous substructure of trypsin (P3121) 分子名称: CALCIUM ION, CHLORIDE ION, Cationic trypsin 著者 Mueller-Dieckmann, C, Weiss, M.S. 登録日 2006-02-22 公開日 2007-02-20 最終更新日 2011-07-13 実験手法 X-RAY DIFFRACTION (1.82 Å) 主引用文献 On the routine use of soft X-rays in macromolecular crystallography. Part IV. Efficient determination of anomalous substructures in biomacromolecules using longer X-ray wavelengths. Acta Crystallogr.,Sect.D, 63, 2007
6T9V	Bovine Trypsin in complex with the synthetic inhibitor (S)-3-(3-(4-(3-(tert-butyl)ureido)piperidin-1-yl)-2-((3'-fluoro-4'-(hydroxymethyl)-[1,1'-biphenyl])-3-sulfonamido)-3-oxopropyl)benzimidamide (MI-1904) 分子名称: 1-~{tert}-butyl-3-[1-[(2~{S})-3-(3-carbamimidoylphenyl)-2-[[3-[3-fluoranyl-4-(hydroxymethyl)phenyl]phenyl]sulfonylamino ]propanoyl]piperidin-4-yl]urea, CALCIUM ION, Cationic Trypsin, ... 著者 Merkl, S, Keils, A, Mueller, J.M, Pilgram, O, Steinmetzer, T. 登録日 2019-10-28 公開日 2020-11-18 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.12642729 Å) 主引用文献 Improving the selectivity of 3-amidinophenylalanine-derived matriptase inhibitors Eur.J.Med.Chem., 2022
5JB5	A simplified BPTI variant containing 22 alanines out of 58 residues 分子名称: Pancreatic trypsin inhibitor, SULFATE ION 著者 Islam, M.M. 登録日 2016-04-13 公開日 2017-04-19 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Crystal structures of highly simplified BPTIs provide insights into hydration-driven increase of unfolding enthalpy Sci Rep, 7, 2017
5JB6	A simplified BPTI variant containing 23 alanines out of 58 residues 分子名称: Pancreatic trypsin inhibitor, SULFATE ION 著者 Islam, M.M. 登録日 2016-04-13 公開日 2017-04-19 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Crystal structures of highly simplified BPTIs provide insights into hydration-driven increase of unfolding enthalpy Sci Rep, 7, 2017
1K9B	Crystal structure of the bifunctional soybean Bowman-Birk inhibitor at 0.28 nm resolution. Structural peculiarities in a folded protein conformation 分子名称: BOWMAN-BIRK TYPE PROTEINASE INHIBITOR 著者 Voss, R.H, Ermler, U, Essen, L.O, Wenzl, G, Kim, Y.M, Flecker, P. 登録日 2001-10-29 公開日 2001-11-16 最終更新日 2023-08-16 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Crystal structure of the bifunctional soybean Bowman-Birk inhibitor at 0.28-nm resolution. Structural peculiarities in a folded protein conformation. Eur.J.Biochem., 242, 1996
1UMA	ALPHA-THROMBIN (HIRUGEN) COMPLEXED WITH NA-(N,N-DIMETHYLCARBAMOYL)-ALPHA-AZALYSINE 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, ALPHA-THROMBIN, HIRUDIN I, ... 著者 Nardini, M, Pesce, A, Rizzi, M, Casale, E, Ferraccioli, R, Balliano, G, Milla, P, Ascenzi, P, Bolognesi, M. 登録日 1996-03-26 公開日 1996-11-08 最終更新日 2020-07-29 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Human alpha-thrombin inhibition by the active site titrant N alpha-(N,N-dimethylcarbamoyl)-alpha-azalysine p-nitrophenyl ester: a comparative kinetic and X-ray crystallographic study. J.Mol.Biol., 258, 1996
3A7V	Crystal Structure of Trypsin complexed with 3-formylbenzimidamide 分子名称: 3-formylbenzenecarboximidamide, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Tanaka, I. 登録日 2009-10-05 公開日 2010-09-29 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 In-Crystal Chemical Ligation for Drug Discovery To be Published
3A87	Crystal Structure of Trypsin complexed with (E)-4-((2-nicotinoylhydrazono)methyl)benzimidamide (soaking 5 minutes) 分子名称: (E)-4-((2-nicotinoylhydrazono)methyl)benzimidamide, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Tanaka, I. 登録日 2009-10-05 公開日 2010-09-29 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 In-Crystal Chemical Ligation for Drug Discovery To be Published
3A7W	Crystal Structure of Trypsin complexed with (E)-4-((tetrahydro-2H-pyran-2-yloxyimino)methyl)benzimidamide (soaking 4hours) 分子名称: (E)-4-((tetrahydro-2H-pyran-2-yloxyimino)methyl)benzimidamide, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Tanaka, I. 登録日 2009-10-05 公開日 2010-09-29 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 In-Crystal Chemical Ligation for Drug Discovery To be Published
3A88	Crystal Structure of Trypsin complexed with (E)-4-((2-nicotinoylhydrazono)methyl)benzimidamide (soaking 30 minutes) 分子名称: (E)-4-((2-nicotinoylhydrazono)methyl)benzimidamide, CALCIUM ION, Cationic trypsin, ... 著者 Yamane, J, Yao, M, Tanaka, I. 登録日 2009-10-05 公開日 2010-09-29 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 In-Crystal Chemical Ligation for Drug Discovery To be Published

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