1UKA
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![BU of 1uka by Molmil](/molmil-images/mine/1uka) | Crystal structure of a meta-cleavage product hydrolase (CumD) complexed with (S)-2-methylbutyrate | 分子名称: | 2-METHYLBUTANOIC ACID, 2-hydroxy-6-oxo-7-methylocta-2,4-dienoate hydrolase | 著者 | Fushinobu, S, Jun, S.-Y, Hidaka, M, Nojiri, H, Yamane, H, Shoun, H, Omori, T, Wakagi, T. | 登録日 | 2003-08-19 | 公開日 | 2004-09-14 | 最終更新日 | 2023-10-25 | 実験手法 | X-RAY DIFFRACTION (1.7 Å) | 主引用文献 | A Series of Crystal Structures of a meta-Cleavage Product Hydrolase from Pseudomonas fluorescens IP01 (CumD) Complexed with Various Cleavage Products BIOSCI.BIOTECHNOL.BIOCHEM., 69, 2005
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1UKB
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![BU of 1ukb by Molmil](/molmil-images/mine/1ukb) | Crystal structure of a meta-cleavage product hydrolase (CumD) complexed with benzoate | 分子名称: | 2-hydroxy-6-oxo-7-methylocta-2,4-dienoate hydrolase, BENZOIC ACID | 著者 | Fushinobu, S, Jun, S.-Y, Hidaka, M, Nojiri, H, Yamane, H, Shoun, H, Omori, T, Wakagi, T. | 登録日 | 2003-08-19 | 公開日 | 2004-09-14 | 最終更新日 | 2023-10-25 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | A Series of Crystal Structures of a meta-Cleavage Product Hydrolase from Pseudomonas fluorescens IP01 (CumD) Complexed with Various Cleavage Products BIOSCI.BIOTECHNOL.BIOCHEM., 69, 2005
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5AKR
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![BU of 5akr by Molmil](/molmil-images/mine/5akr) | ATOMIC RESOLUTION STRUCTURE OF NITRITE BOUND STATE OF THE ACHROMOBACTER CYCLOCLASTES CU NITRITE REDUCTASE AT 0.87 A RESOLUTION | 分子名称: | ACETATE ION, COPPER (II) ION, COPPER-CONTAINING NITRITE REDUCTASE, ... | 著者 | Blakeley, M.P, Hasnain, S.S, Antonyuk, S.V. | 登録日 | 2015-03-05 | 公開日 | 2015-07-08 | 最終更新日 | 2024-01-10 | 実験手法 | X-RAY DIFFRACTION (0.87 Å) | 主引用文献 | Sub-Atomic Resolution X-Ray Crystallography and Neutron Crystallography: Promise, Challenges and Potential. Iucrj, 2, 2015
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1UK9
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![BU of 1uk9 by Molmil](/molmil-images/mine/1uk9) | Crystal structure of a meta-cleavage product hydrolase (CumD) complexed with isovalerate | 分子名称: | 2-hydroxy-6-oxo-7-methylocta-2,4-dienoate hydrolase, ISOVALERIC ACID | 著者 | Fushinobu, S, Jun, S.-Y, Hidaka, M, Nojiri, H, Yamane, H, Shoun, H, Omori, T, Wakagi, T. | 登録日 | 2003-08-19 | 公開日 | 2004-09-14 | 最終更新日 | 2023-10-25 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | A Series of Crystal Structures of a meta-Cleavage Product Hydrolase from Pseudomonas fluorescens IP01 (CumD) Complexed with Various Cleavage Products BIOSCI.BIOTECHNOL.BIOCHEM., 69, 2005
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1YJA
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![BU of 1yja by Molmil](/molmil-images/mine/1yja) | SUBTILISIN BPN' 8397+1 (E.C. 3.4.21.14) (MUTANT WITH MET 50 REPLACED BY PHE, ASN 76 REPLACED BY ASP, GLY 169 REPLACED BY ALA, GLN 206 REPLACED BY CYS, ASN 218 REPLACED BY SER AND LYS 256 REPLACED BY TYR) (M50F, N76D, G169A, Q206C, N218S, AND K256Y) IN 20% DIMETHYLFORMAMIDE | 分子名称: | CALCIUM ION, SUBTILISIN 8397+1 | 著者 | Kidd, R.D, Farber, G.K. | 登録日 | 1996-01-16 | 公開日 | 1996-07-11 | 最終更新日 | 2021-11-03 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | Breaking the low barrier hydrogen bond in a serine protease. Protein Sci., 8, 1999
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1YJC
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![BU of 1yjc by Molmil](/molmil-images/mine/1yjc) | SUBTILISIN BPN' 8397+1 (E.C. 3.4.21.14) (MUTANT WITH MET 50 REPLACED BY PHE, ASN 76 REPLACED BY ASP, GLY 169 REPLACED BY ALA, GLN 206 REPLACED BY CYS, ASN 218 REPLACED BY SER AND LYS 256 REPLACED BY TYR) (M50F, N76D, G169A, Q206C, N218S, AND K256Y) IN 50% DIMETHYLFORMAMIDE | 分子名称: | CALCIUM ION, SUBTILISIN 8397+1 | 著者 | Kidd, R.D, Farber, G.K. | 登録日 | 1996-01-16 | 公開日 | 1996-07-11 | 最終更新日 | 2021-11-03 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | Breaking the low barrier hydrogen bond in a serine protease. Protein Sci., 8, 1999
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2HXX
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2I17
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![BU of 2i17 by Molmil](/molmil-images/mine/2i17) | Human aldose reductase in complex with NADP+ and the inhibitor IDD594 at temperature of 60K | 分子名称: | Aldose reductase, CITRIC ACID, IDD594, ... | 著者 | Petrova, T, Ginell, S, Mitshler, A, Hasemann, I, Schneider, T, Cousido, A, Lunin, V.Y, Joachimiak, A, Podjarny, A. | 登録日 | 2006-08-13 | 公開日 | 2006-08-29 | 最終更新日 | 2023-08-30 | 実験手法 | X-RAY DIFFRACTION (0.81 Å) | 主引用文献 | Ultrahigh-resolution study of protein atomic displacement parameters at cryotemperatures obtained with a helium cryostat. Acta Crystallogr.,Sect.D, 62, 2006
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4YDN
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![BU of 4ydn by Molmil](/molmil-images/mine/4ydn) | High resolution crystal structure of human transthyretin bound to ligand and conjugates of 4-(5-(3,5-dichloro-4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl)phenyl fluorosulfate | 分子名称: | 2,6-dichloro-4-[5-(4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]phenol, 4-[5-(3,5-dichloro-4-hydroxyphenyl)-1,3,4-oxadiazol-2-yl]phenyl sulfurofluoridate, Transthyretin | 著者 | Connelly, S, Bradbury, N.C. | 登録日 | 2015-02-22 | 公開日 | 2015-07-15 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (1.35 Å) | 主引用文献 | A Fluorogenic Aryl Fluorosulfate for Intraorganellar Transthyretin Imaging in Living Cells and in Caenorhabditis elegans. J.Am.Chem.Soc., 137, 2015
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5JPA
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![BU of 5jpa by Molmil](/molmil-images/mine/5jpa) | |
1Y1K
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![BU of 1y1k by Molmil](/molmil-images/mine/1y1k) | Crystal structure of the complex of subtilisin BPN' with chymotrypsin inhibitor 2 T58A mutant | 分子名称: | CALCIUM ION, CITRIC ACID, POLYETHYLENE GLYCOL (N=34), ... | 著者 | Radisky, E.S, Lu, C.J, Kwan, G, Koshland Jr, D.E. | 登録日 | 2004-11-18 | 公開日 | 2005-05-17 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.56 Å) | 主引用文献 | Role of the intramolecular hydrogen bond network in the inhibitory power of chymotrypsin inhibitor 2 Biochemistry, 44, 2005
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1Y3F
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![BU of 1y3f by Molmil](/molmil-images/mine/1y3f) | Crystal structure of the complex of subtilisin BPN' with chymotrypsin inhibitor 2 F69A mutant | 分子名称: | CALCIUM ION, CITRIC ACID, POLYETHYLENE GLYCOL (N=34), ... | 著者 | Radisky, E.S, Lu, C.J, Kwan, G, Koshland Jr, D.E. | 登録日 | 2004-11-24 | 公開日 | 2005-05-17 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.72 Å) | 主引用文献 | Role of the intramolecular hydrogen bond network in the inhibitory power of chymotrypsin inhibitor 2 Biochemistry, 44, 2005
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3ULP
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1RZM
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![BU of 1rzm by Molmil](/molmil-images/mine/1rzm) | Crystal structure of 3-deoxy-D-arabino-heptulosonate-7-phosphate synthase (DAHPS) from Thermotoga maritima complexed with Cd2+, PEP and E4P | 分子名称: | CADMIUM ION, ERYTHOSE-4-PHOSPHATE, PHOSPHOENOLPYRUVATE, ... | 著者 | Shumilin, I.A, Bauerle, R, Wu, J, Woodard, R.W, Kretsinger, R.H. | 登録日 | 2003-12-24 | 公開日 | 2004-08-10 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Crystal Structure of the Reaction Complex of 3-Deoxy-d-arabino-heptulosonate-7-phosphate Synthase from Thermotoga maritima Refines the Catalytic Mechanism and Indicates a New Mechanism of Allosteric Regulation. J.Mol.Biol., 341, 2004
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1Y4D
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![BU of 1y4d by Molmil](/molmil-images/mine/1y4d) | Crystal structure of the complex of subtilisin BPN' with chymotrypsin inhibitor 2 M59R/E60S mutant | 分子名称: | CALCIUM ION, SODIUM ION, chymotrypsin inhibitor 2, ... | 著者 | Radisky, E.S, Lu, C.J, Kwan, G, Koshland Jr, D.E. | 登録日 | 2004-11-30 | 公開日 | 2005-05-17 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | Role of the intramolecular hydrogen bond network in the inhibitory power of chymotrypsin inhibitor 2 Biochemistry, 44, 2005
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1Y3D
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![BU of 1y3d by Molmil](/molmil-images/mine/1y3d) | Crystal structure of the complex of subtilisin BPN' with chymotrypsin inhibitor 2 R67A mutant | 分子名称: | CALCIUM ION, CITRIC ACID, POLYETHYLENE GLYCOL (N=34), ... | 著者 | Radisky, E.S, Lu, C.J, Kwan, G, Koshland Jr, D.E. | 登録日 | 2004-11-24 | 公開日 | 2005-05-17 | 最終更新日 | 2023-08-23 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | Role of the intramolecular hydrogen bond network in the inhibitory power of chymotrypsin inhibitor 2 Biochemistry, 44, 2005
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6HOA
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![BU of 6hoa by Molmil](/molmil-images/mine/6hoa) | TRANSCRIPTIONAL REPRESSOR ETHR FROM MYCOBACTERIUM TUBERCULOSIS IN COMPLEX WITH BDM44830 | 分子名称: | 4-[2-(2-propylpyridin-4-yl)-1,3-thiazol-4-yl]-~{N}-[3,3,3-tris(fluoranyl)propyl]benzamide, GLYCEROL, HTH-type transcriptional regulator EthR | 著者 | Wintjens, R, Wohlkonig, A. | 登録日 | 2018-09-17 | 公開日 | 2018-12-26 | 最終更新日 | 2024-01-24 | 実験手法 | X-RAY DIFFRACTION (1.5 Å) | 主引用文献 | A comprehensive analysis of the protein-ligand interactions in crystal structures of Mycobacterium tuberculosis EthR. Biochim Biophys Acta Proteins Proteom, 1867, 2018
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1MIC
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1MMJ
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![BU of 1mmj by Molmil](/molmil-images/mine/1mmj) | Porcine pancreatic elastase complexed with a potent peptidyl inhibitor, FR136706 | 分子名称: | 2-[4-[[(S)-1-[[(S)-2-[[(RS)-3,3,3-TRIFLUORO-1-ISOPROPYL-2-OXOPROPYL]AMINOCARBONYL]PYRROLIDIN-1-YL-]CARBONYL]-2-METHYLPROPYL]AMINOCARBONYL]BENZOYLAMINO]ACETIC ACID, CALCIUM ION, SULFATE ION, ... | 著者 | Kinoshita, T. | 登録日 | 2002-09-04 | 公開日 | 2002-12-23 | 最終更新日 | 2017-10-11 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | True interaction mode of porcine pancreatic elastase with FR136706, a
potent peptidyl inhibitor Bioorg.Med.Chem.Lett., 13, 2003
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1MGO
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![BU of 1mgo by Molmil](/molmil-images/mine/1mgo) | Horse Liver Alcohol Dehydrogenase Phe93Ala Mutant | 分子名称: | (4S)-2-METHYL-2,4-PENTANEDIOL, 2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOL, Alcohol Dehydrogenase E chain, ... | 著者 | Rubach, J.K, Plapp, B.V. | 登録日 | 2002-08-15 | 公開日 | 2002-11-13 | 最終更新日 | 2024-02-14 | 実験手法 | X-RAY DIFFRACTION (1.2 Å) | 主引用文献 | Mobility of Fluorobenzyl Alcohols Bound to Liver Alcohol Dehydrogenases as Determined by NMR and X-ray Crystallographic Studies Biochemistry, 41, 2002
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5I9J
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![BU of 5i9j by Molmil](/molmil-images/mine/5i9j) | Structure of the cholesterol and lutein-binding domain of human STARD3 at 1.74A | 分子名称: | 1,2-ETHANEDIOL, L(+)-TARTARIC ACID, SULFATE ION, ... | 著者 | Horvath, M.P, Bernstein, P.S, Li, B, George, E.W, Tran, Q.T. | 登録日 | 2016-02-20 | 公開日 | 2016-03-16 | 最終更新日 | 2023-09-27 | 実験手法 | X-RAY DIFFRACTION (1.74 Å) | 主引用文献 | Structure of the lutein-binding domain of human StARD3 at 1.74 angstrom resolution and model of a complex with lutein. Acta Crystallogr.,Sect.F, 72, 2016
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5I9K
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![BU of 5i9k by Molmil](/molmil-images/mine/5i9k) | The structure of microsomal glutathione transferase 1 | 分子名称: | 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, GLUTATHIONE, Microsomal glutathione S-transferase 1, ... | 著者 | Kuang, Q, Purhonen, P, Jegerschold, C, Morgenstern, R, Hebert, H. | 登録日 | 2016-02-20 | 公開日 | 2017-07-12 | 最終更新日 | 2017-08-23 | 実験手法 | ELECTRON CRYSTALLOGRAPHY (3.5 Å) | 主引用文献 | Dead-end complex, lipid interactions and catalytic mechanism of microsomal glutathione transferase 1, an electron crystallography and mutagenesis investigation. Sci Rep, 7, 2017
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3HLL
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![BU of 3hll by Molmil](/molmil-images/mine/3hll) | Crystal Structure of Human p38alpha complexed with PH-797804 | 分子名称: | 2-fluoro-4-[4-(4-fluorophenyl)-1H-pyrazol-3-yl]pyridine, 3-{3-bromo-4-[(2,4-difluorobenzyl)oxy]-6-methyl-2-oxopyridin-1(2H)-yl}-N,4-dimethylbenzamide, HYPOPHOSPHITE, ... | 著者 | Shieh, H.-S, Williams, J.M, Stegeman, R.A, Kurumbail, R.G. | 登録日 | 2009-05-27 | 公開日 | 2009-07-14 | 最終更新日 | 2011-07-13 | 実験手法 | X-RAY DIFFRACTION (1.95 Å) | 主引用文献 | Structural bioinformatics-based prediction of exceptional selectivity of p38 MAP kinase inhibitor PH-797804. Biochemistry, 48, 2009
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1MQF
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![BU of 1mqf by Molmil](/molmil-images/mine/1mqf) | Compound I from Proteus mirabilis catalase | 分子名称: | Catalase, GLYCEROL, OXYGEN ATOM, ... | 著者 | Andreoletti, P, Pernoud, A, Sainz, G, Gouet, P, Jouve, H.M. | 登録日 | 2002-09-16 | 公開日 | 2002-10-02 | 最終更新日 | 2011-07-13 | 実験手法 | X-RAY DIFFRACTION (2.5 Å) | 主引用文献 | Structural studies of Proteus mirabilis catalase in its ground state, oxidized state and in complex with formic acid. Acta Crystallogr.,Sect.D, 59, 2003
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5IA9
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![BU of 5ia9 by Molmil](/molmil-images/mine/5ia9) | The structure of microsomal glutathione transferase 1 in complex with Meisenheimer complex | 分子名称: | 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1-(S-GLUTATHIONYL)-2,4,6-TRINITROCYCLOHEXA-2,5-DIENE, Microsomal glutathione S-transferase 1, ... | 著者 | Kuang, Q, Purhonen, P, Jegerschold, C, Morgenstern, R, Hebert, H. | 登録日 | 2016-02-21 | 公開日 | 2017-07-12 | 最終更新日 | 2017-08-23 | 実験手法 | ELECTRON CRYSTALLOGRAPHY (3.5 Å) | 主引用文献 | Dead-end complex, lipid interactions and catalytic mechanism of microsomal glutathione transferase 1, an electron crystallography and mutagenesis investigation. Sci Rep, 7, 2017
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