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

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3PQD	Crystal structure of L-lactate dehydrogenase from Bacillus subtilis complexed with FBP and NAD+ 分子名称: 1,6-di-O-phosphono-beta-D-fructofuranose, L-lactate dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE 著者 Zhang, Y, Garavito, R.M. 登録日 2010-11-26 公開日 2012-01-18 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (2.376 Å) 主引用文献 Crystal structure of L-lactate dehydrogenase from Bacillus subtilis complexed with FBP and NAD+ To be Published
1H80	1,3-ALPHA-1,4-BETA-D-GALACTOSE-4-SULFATE- 3,6-ANHYDRO-D-GALACTOSE-2-SULFATE 4 GALACTOHYDROLASE 分子名称: CALCIUM ION, CHLORIDE ION, GLYCEROL, ... 著者 Michel, G, Chantalat, L, Dideberg, O. 登録日 2001-01-22 公開日 2001-11-27 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 The Iota-Carrageenase of Alteromonas Fortis. A Beta-Helix Fold-Containing Enzyme for the Degradation of a Highly Polyanionic Polysaccharide J.Biol.Chem., 276, 2001
2XJK	Monomeric Human Cu,Zn Superoxide dismutase 分子名称: COPPER (II) ION, SUPEROXIDE DISMUTASE [CU-ZN], ZINC ION 著者 Saraboji, K, Leinartaite, L, Nordlund, A, Oliveberg, M, Logan, D.T. 登録日 2010-07-07 公開日 2010-09-01 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Folding Catalysis by Transient Coordination of Zn2+ to the Cu Ligands of the Als-Associated Enzyme Cu/Zn Superoxide Dismutase 1. J.Am.Chem.Soc., 132, 2010
5UP7	Crystal Structure of the Ni-bound Human Heavy-Chain Ferritin 122H-delta C-star variant 分子名称: 1,2-ETHANEDIOL, CALCIUM ION, CHLORIDE ION, ... 著者 Bailey, J.B, Zhang, L, Chiong, J.A, Ahn, S, Tezcan, F.A. 登録日 2017-02-01 公開日 2017-06-21 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.79 Å) 主引用文献 Synthetic Modularity of Protein-Metal-Organic Frameworks. J. Am. Chem. Soc., 139, 2017
4J49	PylD holoenzyme soaked with L-lysine-Ne-D-ornithine 分子名称: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, MAGNESIUM ION, NICOTINAMIDE-ADENINE-DINUCLEOTIDE, ... 著者 Quitterer, F, Beck, P, Bacher, A, Groll, M. 登録日 2013-02-06 公開日 2013-06-12 最終更新日 2024-11-27 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Structure and Reaction Mechanism of Pyrrolysine Synthase (PylD). Angew.Chem.Int.Ed.Engl., 52, 2013
7JGM	Crystal Structure of the Ni-bound Human Heavy-chain variant 122H-delta C-star with meta-benzenedihyrdoxamate 分子名称: Ferritin heavy chain, NICKEL (II) ION, N~1~,N~3~-dihydroxybenzene-1,3-dicarboxamide, ... 著者 Bailey, J.B, Tezcan, F.A. 登録日 2020-07-19 公開日 2020-10-14 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.31 Å) 主引用文献 Tunable and Cooperative Thermomechanical Properties of Protein-Metal-Organic Frameworks. J.Am.Chem.Soc., 142, 2020
4GL4	Crystal structure of oxidized S-nitrosoglutathione reductase from Arabidopsis thalina, complex with NADH 分子名称: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, Alcohol dehydrogenase class-3, SULFATE ION, ... 著者 Weichsel, A, Crotty, J, Montfort, W.R. 登録日 2012-08-13 公開日 2013-02-27 最終更新日 2024-11-27 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Crystal structure and kinetic behavior of alcohol dehydrogenase III/S-nitrosoglutathione reductase from arabidopsis thalina To be Published
4GL7	Structure of human placental aromatase complexed with designed inhibitor HDDG046 (compound 5) 分子名称: (6alpha,8alpha)-6-(pent-2-yn-1-yloxy)androsta-1,4-diene-3,17-dione, Cytochrome P450 19A1, PROTOPORPHYRIN IX CONTAINING FE 著者 Ghosh, D. 登録日 2012-08-13 公開日 2012-09-12 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (3.9 Å) 主引用文献 Novel aromatase inhibitors by structure-guided design. J.Med.Chem., 55, 2012
4GUJ	1.50 Angstrom Crystal Structure of the Salmonella enterica 3-Dehydroquinate Dehydratase (aroD) in Complex with Shikimate 分子名称: (3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-1-ENE-1-CARBOXYLIC ACID, 3-dehydroquinate dehydratase, ZINC ION 著者 Light, S.H, Minasov, G, Duban, M.-E, Shuvalova, L, Kwon, K, Lavie, A, Anderson, W.F, Center for Structural Genomics of Infectious Diseases (CSGID) 登録日 2012-08-29 公開日 2012-09-12 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Crystal structures of type I dehydroquinate dehydratase in complex with quinate and shikimate suggest a novel mechanism of schiff base formation. Biochemistry, 53, 2014
4I8P	Crystal structure of aminoaldehyde dehydrogenase 1a from Zea mays (ZmAMADH1a) 分子名称: 1,2-ETHANEDIOL, Aminoaldehyde dehydrogenase 1, DI(HYDROXYETHYL)ETHER, ... 著者 Morera, S, Vigouroux, A, Kopecny, D. 登録日 2012-12-04 公開日 2013-02-20 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Plant ALDH10 family: identifying critical residues for substrate specificity and trapping a thiohemiacetal intermediate. J.Biol.Chem., 288, 2013
4JTQ	AKR1C2 complex with flurbiprofen 分子名称: 1,2-ETHANEDIOL, Aldo-keto reductase family 1 member C2, FLURBIPROFEN, ... 著者 Yosaatmadja, Y, Flanagan, J.U, Squire, C.J. 登録日 2013-03-24 公開日 2014-04-02 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Structural basis of NSAID selectivity for the AKR1C family To be Published
3SFE	crystal structure of porcine mitochondrial respiratory complex II bound with oxaloacetate and thiabendazole 分子名称: 2-(1,3-THIAZOL-4-YL)-1H-BENZIMIDAZOLE, FE2/S2 (INORGANIC) CLUSTER, FE3-S4 CLUSTER, ... 著者 Zhou, Q.J, Zhai, Y.J, Liu, M, Sun, F. 登録日 2011-06-13 公開日 2011-09-07 最終更新日 2024-10-30 実験手法 X-RAY DIFFRACTION (2.81 Å) 主引用文献 Thiabendazole inhibits ubiquinone reduction activity of mitochondrial respiratory complex II via a water molecule mediated binding feature. Protein Cell, 2, 2011
4GVX	Crystal structure of a short chain dehydrogenase homolog (target EFI-505321) from burkholderia multivorans, with bound NADP and L-fucose 分子名称: 1,2-ETHANEDIOL, 3-oxoacyl-[acyl-carrier protein] reductase, CHLORIDE ION, ... 著者 Vetting, M.W, Hobbs, M.E, Morisco, L.L, Wasserman, S.R, Sojitra, S, Imker, H.J, Raushel, F.M, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI) 登録日 2012-08-31 公開日 2012-10-03 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.499 Å) 主引用文献 Crystal structure of a short chain dehydrogenase homolog (target EFI-505321) from burkholderia multivorans, with bound NADP and L-fucose To be Published
4H95	Candida albicans dihydrofolate reductase complexed with NADPH and 6-ethyl-5-{3-[3-methoxy-5-(pyridin-4-yl)phenyl]but-1-yn-1-yl}pyrimidine-2,4-diamine (UCP1006) 分子名称: 6-ethyl-5-{(3R)-3-[3-methoxy-5-(pyridin-4-yl)phenyl]but-1-yn-1-yl}pyrimidine-2,4-diamine, Dihydrofolate Reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE 著者 Paulsen, J.L, Anderson, A.C. 登録日 2012-09-24 公開日 2013-03-27 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Structural analysis of the active sites of dihydrofolate reductase from two species of Candida uncovers ligand-induced conformational changes shared among species. Bioorg.Med.Chem.Lett., 23, 2013
3O0K	Crystal structure of ALDO/KETO reductase from brucella melitensis 分子名称: 1,2-ETHANEDIOL, Aldo/keto reductase, GLYCEROL 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2010-07-19 公開日 2010-08-11 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Crystal structure of ALDO/KETO reductase from brucella melitensis TO BE PUBLISHED
5R8I	PanDDA analysis group deposition INTERLEUKIN-1 BETA -- Fragment Z210803634 in complex with INTERLEUKIN-1 BETA 分子名称: (1~{R})-1-(4-ethoxyphenyl)ethanamine, Interleukin-1 beta, SULFATE ION 著者 De Nicola, G.F, Nichols, C.E. 登録日 2020-03-03 公開日 2020-04-22 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (1.47 Å) 主引用文献 Mining the PDB for Tractable Cases Where X-ray Crystallography Combined with Fragment Screens Can Be Used to Systematically Design Protein-Protein Inhibitors: Two Test Cases Illustrated by IL1 beta-IL1R and p38 alpha-TAB1 Complexes. J.Med.Chem., 63, 2020
4JQA	AKR1C2 complex with mefenamic acid 分子名称: 1,2-ETHANEDIOL, 2-[(2,3-DIMETHYLPHENYL)AMINO]BENZOIC ACID, Aldo-keto reductase family 1 member C2, ... 著者 Yosaatmadja, Y, Flanagan, J.U, Squire, C.J. 登録日 2013-03-20 公開日 2014-04-02 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Structural basis of NSAID selectivity for the aldo-keto reductase 1C family To be Published
3NTR	Crystal structure of K97V mutant of myo-inositol dehydrogenase from Bacillus subtilis with bound cofactor NAD and inositol 分子名称: 1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE, Inositol 2-dehydrogenase/D-chiro-inositol 3-dehydrogenase, NICOTINAMIDE-ADENINE-DINUCLEOTIDE 著者 Van Straaten, K.E, Palmer, D.R.J, Sanders, D.A.R. 登録日 2010-07-05 公開日 2010-09-15 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.6503 Å) 主引用文献 Structural investigation of myo-inositol dehydrogenase from Bacillus subtilis: implications for catalytic mechanism and inositol dehydrogenase subfamily classification. Biochem.J., 432, 2010
2MNX	Major groove orientation of the (2S)-N6-(2-hydroxy-3-buten-1-yl)-2'-deoxyadenosine DNA adduct induced by 1,2-epoxy-3-butene 分子名称: 5'-D(*CP*GP*GP*AP*CP*(6HB)P*AP*GP*AP*AP*G)-3', 5'-D(*CP*TP*TP*CP*TP*TP*GP*TP*CP*CP*G)-3' 著者 Kowal, E.A, Kotapati, S, Turo, M, Tretyakova, N, Stone, M.P. 登録日 2014-04-16 公開日 2014-10-08 最終更新日 2024-05-01 実験手法 SOLUTION NMR 主引用文献 Major Groove Orientation of the (2S)-N(6)-(2-Hydroxy-3-buten-1-yl)-2'-deoxyadenosine DNA Adduct Induced by 1,2-Epoxy-3-butene. Chem.Res.Toxicol., 27, 2014
3OBB	Crystal structure of a possible 3-hydroxyisobutyrate Dehydrogenase from pseudomonas aeruginosa pao1 分子名称: 1,2-ETHANEDIOL, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ACETATE ION, ... 著者 Tan, K, Singer, A.U, Evdokimova, E, Kudritska, M, Savchenko, A, Edwards, A.M, Yakunin, A.F, Joachimiak, A, Midwest Center for Structural Genomics (MCSG) 登録日 2010-08-06 公開日 2010-08-18 最終更新日 2024-10-09 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Biochemical and Structural Studies of Uncharacterized Protein PA0743 from Pseudomonas aeruginosa Revealed NAD+-dependent L-Serine Dehydrogenase. J.Biol.Chem., 287, 2012
7JGN	Crystal Structure of the Zn-bound Human Heavy-chain variant 122H-delta C-star with meta-benzenedihyrdoxamate collected at 100K 分子名称: Ferritin heavy chain, N~1~,N~3~-dihydroxybenzene-1,3-dicarboxamide, SODIUM ION, ... 著者 Bailey, J.B, Tezcan, F.A. 登録日 2020-07-19 公開日 2020-10-14 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.07 Å) 主引用文献 Tunable and Cooperative Thermomechanical Properties of Protein-Metal-Organic Frameworks. J.Am.Chem.Soc., 142, 2020
4J1T	Crystal structure of Thermus thermophilus transhydrogenase heterotrimeric complex of the Alpha1 subunit dimer with the NADP binding domain (domain III) of the Beta subunit in P2(1) 分子名称: GLYCEROL, NAD(P) transhydrogenase subunit beta, NAD/NADP transhydrogenase alpha subunit 1, ... 著者 Yamaguchi, M, Leung, J, Schurig Briccio, L.A, Gennis, R.B, Stout, C.D. 登録日 2013-02-02 公開日 2014-02-05 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.37 Å) 主引用文献 Crystal structure analysis of Thermus thermophilus transhydrogenase soluble domains To be Published
1I6M	1.7 HIGH RESOLUTION EXPERIMENTAL PHASES FOR TRYPTOPHANYL-TRNA SYNTHETASE COMPLEXED WITH TRYPTOPHANYL-5'AMP 分子名称: AMMONIUM ION, GLYCEROL, SULFATE ION, ... 著者 Retailleau, P, Carter, C.W. 登録日 2001-03-02 公開日 2001-11-07 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (1.72 Å) 主引用文献 High-resolution experimental phases for tryptophanyl-tRNA synthetase (TrpRS) complexed with tryptophanyl-5'AMP. Acta Crystallogr.,Sect.D, 57, 2001
4JQ4	AKR1C2 complex with indomethacin 分子名称: 1,2-ETHANEDIOL, Aldo-keto reductase family 1 member C2, INDOMETHACIN, ... 著者 Yosaatmadja, Y, Flanagan, J.U, Squire, C.J. 登録日 2013-03-19 公開日 2014-04-02 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.52 Å) 主引用文献 Structural basis of NSAID selectivity for the aldo-keto reductase 1C family To be Published
3FQ0	Staphylococcus aureus dihydrofolate reductase complexed with NADPH and 2,4-diamino-5-(3-(2,5-dimethoxyphenyl)prop-1-ynyl)-6-ethylpyrimidine (UCP120B) 分子名称: 5-[3-(2,5-dimethoxyphenyl)prop-1-yn-1-yl]-6-ethylpyrimidine-2,4-diamine, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Trimethoprim-sensitive dihydrofolate reductase 著者 Anderson, A.C, Frey, K.M, Liu, J, Lombardo, M.N. 登録日 2009-01-06 公開日 2009-03-24 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.69 Å) 主引用文献 Crystal structures of wild-type and mutant methicillin-resistant Staphylococcus aureus dihydrofolate reductase reveal an alternate conformation of NADPH that may be linked to trimethoprim resistance. J.Mol.Biol., 387, 2009

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