PDB: 35756 件ウェブページステータス検索Chemie searchBIRD

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7PUT	Crystal structure of Thioredoxin Reductase from Brugia Malayi in complex with NADP(H) 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 2'-MONOPHOSPHOADENOSINE-5'-DIPHOSPHATE, FLAVIN-ADENINE DINUCLEOTIDE, ... 著者 Fata, F, Ardini, M, Silvestri, I, Gabriele, F, Ippoliti, R, Gencheva, R, Cheng, Q, Arner, E.S.J, Angelucci, F, Williams, D.L. 登録日 2021-09-30 公開日 2022-04-06 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Biochemical and structural characterizations of thioredoxin reductase selenoproteins of the parasitic filarial nematodes Brugia malayi and Onchocerca volvulus. Redox Biol, 51, 2022
2RI6	Crystal Structure of S112A mutant of a C-C hydrolase, BphD from Burkholderia xenovorans LB400 分子名称: 2-hydroxy-6-oxo-6-phenylhexa-2,4-dienoate hydrolase, MALONATE ION, SODIUM ION 著者 Bhowmik, S, Bolin, J.T. 登録日 2007-10-10 公開日 2007-11-06 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (1.68 Å) 主引用文献 The tautomeric half-reaction of BphD, a C-C bond hydrolase. Kinetic and structural evidence supporting a key role for histidine 265 of the catalytic triad. J.Biol.Chem., 282, 2007
7PSA	The acetogenin-bound complex I of Mus musculus resolved to 3.4 angstroms 分子名称: (3~{S},5~{S})-5-methyl-3-[(13~{R})-13-oxidanyl-13-[(2~{R},5~{R})-5-[(2~{R},5~{R})-5-[(1~{R})-1-oxidanylundecyl]oxolan-2-yl]oxolan-2-yl]tridecyl]oxolan-2-one, 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE, 1,2-Distearoyl-sn-glycerophosphoethanolamine, ... 著者 Grba, D, Hirst, J. 登録日 2021-09-22 公開日 2022-04-06 実験手法 ELECTRON MICROSCOPY (3.4 Å) 主引用文献 Cryo-electron microscopy reveals how acetogenins inhibit mitochondrial respiratory complex I. J.Biol.Chem., 298, 2022
6IO6	Silver-bound Glyceraldehyde-3-phosphate dehydrogenase A at non-catalytic site 分子名称: Glyceraldehyde-3-phosphate dehydrogenase A, SILVER ION 著者 Wang, H, Sun, H, Wang, M. 登録日 2018-10-29 公開日 2019-07-03 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.64 Å) 主引用文献 Antimicrobial silver targets glyceraldehyde-3-phosphate dehydrogenase in glycolysis ofE. coli. Chem Sci, 10, 2019
3E2T	The catalytic domain of chicken tryptophan hydroxylase 1 with bound tryptophan 分子名称: FE (III) ION, IMIDAZOLE, SULFATE ION, ... 著者 Windahl, M.S, Petersen, C.R, Christensen, H.E.C, Harris, P. 登録日 2008-08-06 公開日 2008-11-04 最終更新日 2023-11-01 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Crystal structure of tryptophan hydroxylase with bound amino acid substrate Biochemistry, 47, 2008
5X3K	Kfla1895 D451A mutant in complex with isomaltose 分子名称: GLYCEROL, Glycoside hydrolase family 31, SULFATE ION, ... 著者 Tanaka, Y, Chen, M, Tagami, T, Yao, M, Kimura, A. 登録日 2017-02-06 公開日 2018-02-07 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Glycoside hydrolase mutant in complex with product To Be Published
6EHH	Crystal structure of mouse MTH1 mutant L116M with inhibitor TH588 分子名称: 7,8-dihydro-8-oxoguanine triphosphatase, COPPER (II) ION, DI(HYDROXYETHYL)ETHER, ... 著者 Gustafsson, R, Narwal, M, Jemth, A.-S, Almlof, I, Warpman Berglund, U, Helleday, T, Stenmark, P. 登録日 2017-09-13 公開日 2018-01-10 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Crystal Structures and Inhibitor Interactions of Mouse and Dog MTH1 Reveal Species-Specific Differences in Affinity. Biochemistry, 57, 2018
4M81	The structure of E292S glycosynthase variant of exo-1,3-beta-glucanase from Candida albicans complexed with 1-fluoro-alpha-D-glucopyranoside (donor) and p-nitrophenyl beta-D-glucopyranoside (acceptor) at 1.86A resolution 分子名称: 4-nitrophenyl beta-D-glucopyranoside, EXO-1,3-BETA-GLUCANASE, GLYCEROL, ... 著者 Nakatani, Y, Cutfield, S.M, Larsen, D.S, Cutfield, J.F. 登録日 2013-08-12 公開日 2014-06-25 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.86 Å) 主引用文献 Major Change in Regiospecificity for the Exo-1,3-beta-glucanase from Candida albicans following Its Conversion to a Glycosynthase. Biochemistry, 53, 2014
2IHN	Co-crystal of Bacteriophage T4 RNase H with a fork DNA substrate 分子名称: 5'-D(*CP*TP*AP*AP*CP*TP*TP*TP*GP*AP*GP*GP*CP*AP*GP*AP*CP*C)-3', 5'-D(*GP*GP*TP*CP*TP*GP*CP*CP*TP*CP*AP*AP*GP*AP*CP*GP*GP*TP*AP*GP*TP*CP*AP*A)-3', Ribonuclease H 著者 Devos, J.M, Mueser, T.C. 登録日 2006-09-26 公開日 2007-08-21 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 Crystal structure of bacteriophage T4 5' nuclease in complex with a branched DNA reveals how FEN-1 family nucleases bind their substrates. J.Biol.Chem., 282, 2007
2RK4	Structure of M26I DJ-1 分子名称: Protein DJ-1 著者 Lakshminarasimhan, M, Maldonado, M.T, Zhou, W, Fink, A.L, Wilson, M.A. 登録日 2007-10-16 公開日 2008-01-15 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.15 Å) 主引用文献 Structural Impact of Three Parkinsonism-Associated Missense Mutations on Human DJ-1. Biochemistry, 47, 2008
6IM6	Crystal structure of PDE4D complexed with a novel inhibitor 分子名称: 1,2-ETHANEDIOL, 7-ethoxy-6-methoxy-3,4-dihydroisoquinoline-2(1H)-carbaldehyde, MAGNESIUM ION, ... 著者 Zhang, X.L, Su, H.X, Xu, Y.C. 登録日 2018-10-22 公開日 2019-10-23 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (1.702 Å) 主引用文献 Structure-Aided Identification and Optimization of Tetrahydro-isoquinolines as Novel PDE4 Inhibitors Leading to Discovery of an Effective Antipsoriasis Agent. J.Med.Chem., 62, 2019
6EOH	Reductive Aminase from Aspergillus terreus in complex with NADPH and ethyl levulinate 分子名称: NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Reductive Aminase, ethyl levulinate 著者 Sharma, M, Grogan, G, Mangas-Sanchez, J, Turner, N.J. 登録日 2017-10-09 公開日 2018-10-31 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 A Mechanism for Reductive Amination Catalyzed by Fungal Reductive Aminases Acs Catalysis, 2018
3HDE	Crystal structure of full-length endolysin R21 from phage 21 分子名称: Lysozyme 著者 Sun, Q, Arockiasamy, A, McKee, E, Caronna, E, Sacchettini, J.C. 登録日 2009-05-07 公開日 2009-11-03 最終更新日 2017-11-01 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Regulation of a muralytic enzyme by dynamic membrane topology. Nat.Struct.Mol.Biol., 16, 2009
5XHJ	Crystal Structure of P450BM3 with 5-Cyclohexylvaleroyl-L-Tryptophan 分子名称: 5-cyclohexylpentanoic acid, Bifunctional cytochrome P450/NADPH--P450 reductase, PROTOPORPHYRIN IX CONTAINING FE, ... 著者 Suzuki, K, Shoji, O, Stanfield, J.K, Kasai, C, Sugimoto, H, Shiro, Y, Watanabe, Y. 登録日 2017-04-21 公開日 2017-12-06 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Control of stereoselectivity of benzylic hydroxylation catalysed by wild-type cytochrome P450BM3 using decoy molecules CATALYSIS SCIENCE AND TECHNOLOGY, 7, 2017
6IMT	Crystal structure of PDE4D complexed with a novel inhibitor 分子名称: (1S)-1-[2-(6-fluoro-1H-indol-3-yl)ethyl]-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-carbaldehyde, 1,2-ETHANEDIOL, MAGNESIUM ION, ... 著者 Zhang, X.L, Su, H.X, Xu, Y.C. 登録日 2018-10-23 公開日 2019-10-23 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (1.483 Å) 主引用文献 Structure-Aided Identification and Optimization of Tetrahydro-isoquinolines as Novel PDE4 Inhibitors Leading to Discovery of an Effective Antipsoriasis Agent. J.Med.Chem., 62, 2019
6EP4	Human butyrylcholinesterase in complex with decamethonium 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[beta-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, CHLORIDE ION, ... 著者 Nachon, F, Brazzolotto, X, Wandhammer, M, Trovaslet-Leroy, M, Rosenberry, T.L, Macdonald, I.R, Darvesh, S. 登録日 2017-10-10 公開日 2017-12-13 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.30005383 Å) 主引用文献 Comparison of the Binding of Reversible Inhibitors to Human Butyrylcholinesterase and Acetylcholinesterase: A Crystallographic, Kinetic and Calorimetric Study. Molecules, 22, 2017
6ABZ	Crystal Structure of HEWL in deionized water 分子名称: CHLORIDE ION, Lysozyme C, S-1,2-PROPANEDIOL, ... 著者 Seyedarabi, A, Seraj, Z. 登録日 2018-07-24 公開日 2019-07-31 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 The role of Cinnamaldehyde and Phenyl ethyl alcohol as two types of precipitants affecting protein hydration levels. Int.J.Biol.Macromol., 146, 2019
4PHI	Crystal structure of HEWL with hexatungstotellurate(VI) 分子名称: 6-tungstotellurate(VI), ACETATE ION, GLYCEROL, ... 著者 Bijelic, A, Molitor, C, Mauracher, S.G, Al-Oweini, R, Kortz, U, Rompel, A. 登録日 2014-05-06 公開日 2015-01-14 最終更新日 2015-01-21 実験手法 X-RAY DIFFRACTION (1.811 Å) 主引用文献 Hen Egg-White Lysozyme Crystallisation: Protein Stacking and Structure Stability Enhanced by a Tellurium(VI)-Centred Polyoxotungstate. Chembiochem, 16, 2015
6EQ3	MTH1 in complex with fragment 9 分子名称: 7,8-dihydro-8-oxoguanine triphosphatase, SULFATE ION, [2-(1~{H}-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazol-4-yl]methanol 著者 Wiedmer, L, Sledz, P, Caflisch, A. 登録日 2017-10-12 公開日 2018-10-31 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (1.798 Å) 主引用文献 Ligand retargeting by binding site analogy. Eur.J.Med.Chem., 175, 2019
7V40	Crystal structure of Class I P450 monooxygenase (P450tol) from Rhodococcus coprophilus TC-2 分子名称: PHOSPHATE ION, PROTOPORPHYRIN IX CONTAINING FE, p450tol monooxygenase 著者 Zhang, L.L, Huang, J.W, Liu, W.D, Chen, C.C, Guo, R.T. 登録日 2021-08-12 公開日 2022-06-22 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.43 Å) 主引用文献 Molecular Basis for a Toluene Monooxygenase to Govern Substrate Selectivity Acs Catalysis, 12, 2022
7V41	Crystal structure of Class I P450 monooxygenase (P450tol) from Rhodococcus coprophilus TC-2 in complex with toluene. 分子名称: PHOSPHATE ION, PROTOPORPHYRIN IX CONTAINING FE, TOLUENE, ... 著者 Zhang, L.L, Huang, J.W, Liu, W.D, Chen, C.C, Guo, R.T. 登録日 2021-08-12 公開日 2022-06-22 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Molecular Basis for a Toluene Monooxygenase to Govern Substrate Selectivity Acs Catalysis, 12, 2022
6IO0	Human IDH1 R132C mutant complexed with compound A. 分子名称: (2E)-3-{3-[3-(2,6-dichlorophenyl)-5-(propan-2-yl)-1,2-oxazole-4-carbonyl]-1-methyl-1H-indol-7-yl}prop-2-enoic acid, CITRIC ACID, GLYCEROL, ... 著者 Suzuki, M, Baba, D, Hanzawa, H. 登録日 2018-10-29 公開日 2019-10-30 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 A Potent Blood-Brain Barrier-Permeable Mutant IDH1 Inhibitor Suppresses the Growth of Glioblastoma with IDH1 Mutation in a Patient-Derived Orthotopic Xenograft Model. Mol.Cancer Ther., 19, 2020
6EQ5	MTH1 in complex with fragment 4 分子名称: 1H-benzimidazol-2-amine, 7,8-dihydro-8-oxoguanine triphosphatase, SULFATE ION 著者 Wiedmer, L, Sledz, P, Caflisch, A. 登録日 2017-10-12 公開日 2018-10-31 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (1.801 Å) 主引用文献 Ligand retargeting by binding site analogy. Eur.J.Med.Chem., 175, 2019
4PRU	Crystal structure of dimethyllysine hen egg-white lysozyme in complex with sclx4 at 2.2 A resolution 分子名称: 25,26,27,28-tetrahydroxypentacyclo[19.3.1.1~3,7~.1~9,13~.1~15,19~]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-5,11,17,23-tetrasulfonic acid, GLYCEROL, Lysozyme C 著者 McGovern, R.E, Lyons, J.A, Crowley, P.B. 登録日 2014-03-06 公開日 2014-11-12 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Structural study of a small molecule receptor bound to dimethyllysine in lysozyme. Chem Sci, 6, 2015
7V44	Crystal structure of Class I P450 monooxygenase (P450tol) from Rhodococcus coprophilus TC-2 in complex with meta-chlorotoluene. 分子名称: 1-chloranyl-2-methyl-benzene, GLYCEROL, PHOSPHATE ION, ... 著者 Zhang, L.L, Huang, J.W, Liu, W.D, Chen, C.C, Guo, R.T. 登録日 2021-08-12 公開日 2022-06-22 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.42 Å) 主引用文献 Molecular Basis for a Toluene Monooxygenase to Govern Substrate Selectivity Acs Catalysis, 12, 2022

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