PDB: 243083 件ウェブページステータス検索Chemie searchBIRD

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4CHL	Human Ethylmalonic Encephalopathy Protein 1 (hETHE1) 分子名称: FE (III) ION, PERSULFIDE DIOXYGENASE ETHE1, MITOCHONDRIAL 著者 Pettinati, I, Brem, J, McDonough, M.A, Schofield, C.J. 登録日 2013-12-03 公開日 2014-12-17 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2.61 Å) 主引用文献 Crystal structure of human persulfide dioxygenase: structural basis of ethylmalonic encephalopathy. Hum. Mol. Genet., 24, 2015
4IJ3	Oxidoreductase Fragment of Human QSOX1 in Complex with a FAB Fragment from an Anti- Human QSOX1 Antibody 分子名称: Heavy chain of FAB fragment, Light chain of FAB fragment, PHOSPHATE ION, ... 著者 Fass, D, Grossman, I. 登録日 2012-12-21 公開日 2013-11-06 最終更新日 2024-10-30 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 An Inhibitory Antibody Blocks the First Step in the Dithiol/Disulfide Relay Mechanism of the Enzyme QSOX1. J.Mol.Biol., 425, 2013
6N2W	The structure of Stable-5-Lipoxygenase bound to NDGA 分子名称: 4-[(2R,3S)-3-[(3,4-DIHYDROXYPHENYL)METHYL]-2-METHYLBUTYL]BENZENE-1,2-DIOL, Arachidonate 5-lipoxygenase, FE (II) ION 著者 Newcomer, M.E, Gilbert, N.C, Neau, D.B. 登録日 2018-11-14 公開日 2020-05-13 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.71 Å) 主引用文献 Structural and mechanistic insights into 5-lipoxygenase inhibition by natural products. Nat.Chem.Biol., 16, 2020
5VAR	Crystal structure of KDM4A tandem TUDOR domain in complex with a tri-methyl lysine competitive inhibitor 分子名称: (1R,2S,3R,4S)-3-[(dimethylamino)methyl]-1-phenylbicyclo[2.2.1]heptan-2-ol, Lysine-specific demethylase 4A 著者 Judge, R.A, Upadhyay, A.K. 登録日 2017-03-27 公開日 2018-03-28 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.83 Å) 主引用文献 Targeting lysine specific demethylase 4A (KDM4A) tandem TUDOR domain - A fragment based approach. Bioorg. Med. Chem. Lett., 28, 2018
5VVB	Structure of human endothelial nitric oxide synthase heme domain in complex with 4-(2-(((2-Aminoquinolin-7-yl)methyl)amino)ethyl)-2-methylbenzonitrile 分子名称: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 4-(2-{[(2-aminoquinolin-7-yl)methyl]amino}ethyl)-2-methylbenzonitrile, 5,6,7,8-TETRAHYDROBIOPTERIN, ... 著者 Li, H, Poulos, T.L. 登録日 2017-05-19 公開日 2017-08-16 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.15 Å) 主引用文献 Hydrophilic, Potent, and Selective 7-Substituted 2-Aminoquinolines as Improved Human Neuronal Nitric Oxide Synthase Inhibitors. J. Med. Chem., 60, 2017
4PIY	Homocysteine bound Cysteine Dioxygenase C93A variant at pH 6.2 分子名称: 2-AMINO-4-MERCAPTO-BUTYRIC ACID, Cysteine dioxygenase type 1, FE (III) ION 著者 Driggers, C.M, Karplus, P.A. 登録日 2014-05-09 公開日 2016-02-17 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Structure-Based Insights into the Role of the Cys-Tyr Crosslink and Inhibitor Recognition by Mammalian Cysteine Dioxygenase. J. Mol. Biol., 428, 2016
2G19	Cellular Oxygen Sensing: Crystal Structure of Hypoxia-Inducible Factor Prolyl Hydroxylase (PHD2) 分子名称: Egl nine homolog 1, FE (II) ION, N-[(4-HYDROXY-8-IODOISOQUINOLIN-3-YL)CARBONYL]GLYCINE 著者 Syed, R.S, Li, V. 登録日 2006-02-14 公開日 2006-06-13 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Cellular oxygen sensing: Crystal structure of hypoxia-inducible factor prolyl hydroxylase (PHD2). Proc.Natl.Acad.Sci.Usa, 103, 2006
1MZY	Crystal Structure of Nitrite Reductase 分子名称: COPPER (II) ION, Copper-containing nitrite reductase, MAGNESIUM ION 著者 Guo, H, Olesen, K, Xue, Y, Shapliegh, J, Sjolin, L. 登録日 2002-10-10 公開日 2004-09-28 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (1.46 Å) 主引用文献 The High resolution Crystal Structures of Nitrite Reductase and its mutant Met182Thr from Rhodobacter Sphaeroides Reveal a Gating Mechanism for the Electron Transfer to the Type 1 Copper Center To be Published
1N5W	Crystal Structure of the Cu,Mo-CO Dehydrogenase (CODH); Oxidized form 分子名称: CU(I)-S-MO(VI)(=O)OH CLUSTER, Carbon monoxide dehydrogenase large chain, Carbon monoxide dehydrogenase medium chain, ... 著者 Dobbek, H, Gremer, L, Kiefersauer, R, Huber, R, Meyer, O. 登録日 2002-11-07 公開日 2002-12-23 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Catalysis at a dinuclear [CuSMo(=O)OH] cluster in a CO dehydrogenase resolved at 1.1-A resolution Proc.Natl.Acad.Sci.USA, 99, 2002
1N63	Crystal Structure of the Cu,Mo-CO Dehydrogenase (CODH); Carbon monoxide reduced state 分子名称: CU(I)-S-MO(IV)(=O)OH CLUSTER, Carbon monoxide dehydrogenase large chain, Carbon monoxide dehydrogenase medium chain, ... 著者 Dobbek, H, Gremer, L, Kiefersauer, R, Huber, R, Meyer, O. 登録日 2002-11-08 公開日 2002-12-18 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.21 Å) 主引用文献 Catalysis at a dinuclear [CuSMo(=O)OH] cluster in a CO dehydrogenase resolved at 1.1-A resolution Proc.Natl.Acad.Sci.USA, 99, 2002
1N61	Crystal Structure of the Cu,Mo-CO Dehydrogenase (CODH); Dithionite reduced state 分子名称: CU(I)-S-MO(IV)(=O)OH CLUSTER, Carbon monoxide dehydrogenase large chain, Carbon monoxide dehydrogenase medium chain, ... 著者 Dobbek, H, Gremer, L, Kiefersauer, R, Huber, R, Meyer, O. 登録日 2002-11-08 公開日 2002-12-18 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.3 Å) 主引用文献 Catalysis at a dinuclear [CuSMo(=O)OH] cluster in a CO dehydrogenase resolved at 1.1-A resolution Proc.Natl.Acad.Sci.USA, 99, 2002
1ZX1	Human quinone oxidoreductase 2 (NQO2) in complex with the cytostatic prodrug CB1954 分子名称: 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE, FLAVIN-ADENINE DINUCLEOTIDE, NRH dehydrogenase [quinone] 2, ... 著者 Jansson, A, Wu, X, Kavanagh, K, Kerr, D, Knox, R, Walton, R, Gunther, U, Ludwig, C, Edwards, A, Arrowsmith, C, Sundstrom, M, von Delft, F, Oppermann, U, Structural Genomics Consortium (SGC) 登録日 2005-06-06 公開日 2005-06-14 最終更新日 2023-08-23 実験手法 X-RAY DIFFRACTION (2.16 Å) 主引用文献 Human quinone oxidoreductase 2 (NQO2) in complex with the cytostatic prodrug CB1954 To be Published
1J01	Crystal Structure Of The Xylanase Cex With Xylobiose-Derived Inhibitor Isofagomine lactam 分子名称: (3S,4R)-3-hydroxy-2-oxopiperidin-4-yl beta-D-xylopyranoside, beta-1,4-xylanase 著者 Williams, S.J, Notenboom, V, Wicki, J, Rose, D.R, Withers, S.G. 登録日 2002-10-25 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 A New, Simple, High-Affinity Glycosidase Inhibitor: Analysis of Binding through X-ray Crystallography, Mutagenesis, and Kinetic Analysis J.Am.Chem.Soc., 122, 2000
2HHZ	Crystal structure of a pyridoxamine 5'-phosphate oxidase-related protein (ssuidraft_2804) from streptococcus suis 89/1591 at 2.00 A resolution 分子名称: ACETATE ION, CHLORIDE ION, PHOSPHATE ION, ... 著者 Joint Center for Structural Genomics (JCSG) 登録日 2006-06-28 公開日 2006-08-15 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Crystal structure of Pyridoxamine 5'-phosphate oxidase-related (ZP_00875725.1) from STREPTOCOCCUS SUIS 89-1591 at 2.00 A resolution To be published
2YR6	Crystal structure of L-phenylalanine oxidase from Psuedomonas sp.P501 分子名称: 2-AMINOBENZOIC ACID, FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, ... 著者 Ida, K, Kurabayashi, M, Suguro, M, Suzuki, H. 登録日 2007-04-02 公開日 2008-04-15 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (1.35 Å) 主引用文献 Structural basis of proteolytic activation of L-phenylalanine oxidase from Pseudomonas sp. P-501. J.Biol.Chem., 283, 2008
1OPM	OXIDIZED (CU2+) PEPTIDYLGLYCINE ALPHA-HYDROXYLATING MONOOXYGENASE (PHM) WITH BOUND SUBSTRATE 分子名称: AZIDE ION, COPPER (II) ION, GLYCEROL, ... 著者 Prigge, S.T, Amzel, L.M. 登録日 1999-05-25 公開日 1999-09-29 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Substrate-mediated electron transfer in peptidylglycine alpha-hydroxylating monooxygenase. Nat.Struct.Biol., 6, 1999
1ECM	ATOMIC STRUCTURE OF THE BURIED CATALYTIC POCKET OF ESCHERICHIA COLI CHORISMATE MUTASE 分子名称: 8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-6-ENE-3,5-DICARBOXYLIC ACID, ENDO-OXABICYCLIC TRANSITION STATE ANALOGUE 著者 Clardy, J, Lee, A.Y. 登録日 1994-11-28 公開日 1995-12-01 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 ATOMIC-STRUCTURE OF THE BURIED CATALYTIC POCKET OF ESCHERICHIA-COLI CHORISMATE MUTASE. J.Am.Chem.Soc., 117, 1995
3W8Z	The complex structure of EncM with hydroxytetraketide 分子名称: (7S)-7-hydroxy-1-phenyloctane-1,3,5-trione, FLAVIN-ADENINE DINUCLEOTIDE, Putative FAD-dependent oxygenase EncM 著者 Teufel, R, Miyanaga, A, Stull, F, Michaudel, Q, Louie, G, Noel, J.P, Baran, P.S, Palfey, B, Moore, B.S. 登録日 2013-03-22 公開日 2013-10-30 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Flavin-mediated dual oxidation controls an enzymatic Favorskii-type rearrangement. Nature, 503, 2013
1JIP	P450eryF(A245S)/ketoconazole 分子名称: CIS-1-ACETYL-4-(4-((2-(2,4-DICHLOROPHENYL)-2-(1H-IMIDAZOL-1-YLMETHYL)-1,3-DIOXOLAN-4-YL)METHOXY)PHENYL)PIPERAZINE, CYTOCHROME P450 107A1, PROTOPORPHYRIN IX CONTAINING FE 著者 Cupp-Vickery, J.R, Garcia, C, Hofacre, A, McGee-Estrada, K. 登録日 2001-07-02 公開日 2001-10-17 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Ketoconazole-induced conformational changes in the active site of cytochrome P450eryF. J.Mol.Biol., 311, 2001
4LS1	Crystal structure of human dihydroorotate dehydrogenase (DHODH) with DH03A312 分子名称: 2-[(E)-{2-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]hydrazinylidene}methyl]benzoic acid, ACETATE ION, Dihydroorotate dehydrogenase (quinone), ... 著者 Zhu, L, Li, H, Ren, X, Zhu, J. 登録日 2013-07-21 公開日 2014-07-23 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 human dihydroorotate dehydrogenase (DHODH) with DH03A312 To be Published
4E5D	2.2A resolution structure of a firefly luciferase-benzothiazole inhibitor complex 分子名称: 2-(2-fluorophenyl)-6-methoxy-1,3-benzothiazole, Luciferin 4-monooxygenase 著者 Lovell, S, Battaile, K.P, Throne, N, Shen, M, Auld, D.S, Inglese, J. 登録日 2012-03-14 公開日 2012-09-05 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.201 Å) 主引用文献 Firefly luciferase in chemical biology: a compendium of inhibitors, mechanistic evaluation of chemotypes, and suggested use as a reporter. Chem.Biol., 19, 2012
1RIE	STRUCTURE OF A WATER SOLUBLE FRAGMENT OF THE RIESKE IRON-SULFUR PROTEIN OF THE BOVINE HEART MITOCHONDRIAL CYTOCHROME BC1-COMPLEX 分子名称: FE2/S2 (INORGANIC) CLUSTER, RIESKE IRON-SULFUR PROTEIN 著者 Iwata, S, Saynovits, M, Link, T.A, Michel, H. 登録日 1996-02-23 公開日 1996-12-07 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Structure of a water soluble fragment of the 'Rieske' iron-sulfur protein of the bovine heart mitochondrial cytochrome bc1 complex determined by MAD phasing at 1.5 A resolution. Structure, 4, 1996
3L1R	X-ray structure of the mutant lys300met of polyamine oxidase from zea mays in complex with spermidine 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, ... 著者 Fiorillo, A, Ilari, A, Tavladoraki, P. 登録日 2009-12-14 公開日 2010-12-15 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (3.2 Å) 主引用文献 The crystal structure of the mutant k300m of polyamine oxidase from zea mays unveils the role of lys300 in catalysis To be Published
1BUL	6ALPHA-(HYDROXYPROPYL)PENICILLANATE ACYLATED ON NMC-A BETA-LACTAMASE FROM ENTEROBACTER CLOACAE 分子名称: 2-(1-CARBOXY-2-HYDROXY-2-METHYL-PROPYL)-5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, NMC-A BETA-LACTAMASE 著者 Mourey, L, Swaren, P, Miyashita, K, Bulychev, A, Mobashery, S, Samama, J.P. 登録日 1998-09-04 公開日 1998-12-30 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.89 Å) 主引用文献 Inhibition of the Nmc-A B-Lactamase by a Penicillanic Acid Derivative, and the Structural Bases for the Increase in Substrate Profile of This Antibiotic Resistance Enzyme J.Am.Chem.Soc., 120, 1998
5UEC	Crystal Structure of CYP2B6 (Y226H/K262R) in complex with myrtenyl bromide. 分子名称: (1S,5R)-2-(bromomethyl)-6,6-dimethylbicyclo[3.1.1]hept-2-ene, 5-CYCLOHEXYL-1-PENTYL-BETA-D-MALTOSIDE, Cytochrome P450 2B6, ... 著者 Shah, M.B, Halpert, J.R. 登録日 2016-12-30 公開日 2017-04-12 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.27 Å) 主引用文献 Halogen-pi Interactions in the Cytochrome P450 Active Site: Structural Insights into Human CYP2B6 Substrate Selectivity. ACS Chem. Biol., 12, 2017

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