PDB: 35415 件ウェブページステータス検索Chemie searchBIRD

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8GCS	XFEL structure of Mycobacterium tuberculosis beta lactamase microcrystals mixed with sulbactam for 3 ms 分子名称: Beta-lactamase, PHOSPHATE ION 著者 Malla, T.N, Schmidt, M. 登録日 2023-03-03 公開日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.62 Å) 主引用文献 Heterogeneity in M. tuberculosis beta-lactamase inhibition by Sulbactam. Nat Commun, 14, 2023
8DGP	14-3-3 epsilon bound to phosphorylated PEAK3 (pS69) peptide 分子名称: 1,2-ETHANEDIOL, 14-3-3 protein epsilon, Phosphorylated PEAK3 (pS69) peptide, ... 著者 Roy, M.J, Hardy, J.M, Lucet, I.S. 登録日 2022-06-24 公開日 2023-06-07 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Structural mapping of PEAK pseudokinase interactions identifies 14-3-3 as a molecular switch for PEAK3 signaling. Nat Commun, 14, 2023
5MST	Structure of the A domain of carboxylic acid reductase (CAR) from Segniliparus rugosus in complex with AMP and a co-purified carboxylic acid 分子名称: ADENOSINE MONOPHOSPHATE, CALCIUM ION, FUMARIC ACID, ... 著者 Gahloth, D, Leys, D. 登録日 2017-01-05 公開日 2017-07-05 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.72 Å) 主引用文献 Structures of carboxylic acid reductase reveal domain dynamics underlying catalysis. Nat. Chem. Biol., 13, 2017
6BL0	Novel Modes of Inhibition of Wild-Type IDH1:Direct Covalent Modification of His315 with Cmpd11 分子名称: (5aS,6S,8S,9aS)-2-(benzenecarbonyl)-6-methyl-7-oxo-9a-phenyl-4,5,5a,6,7,8,9,9a-octahydro-2H-benzo[g]indazole-8-carbonitrile, ISOCITRIC ACID, Isocitrate dehydrogenase [NADP] cytoplasmic, ... 著者 Jakob, C.G, Qiu, W. 登録日 2017-11-09 公開日 2018-07-25 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.17 Å) 主引用文献 Novel Modes of Inhibition of Wild-Type Isocitrate Dehydrogenase 1 (IDH1): Direct Covalent Modification of His315. J. Med. Chem., 61, 2018
8GCX	XFEL structure of Mycobacterium tuberculosis beta lactamase microcrystals mixed with sulbactam for 700 ms 分子名称: Beta-lactamase, PHOSPHATE ION, TRANS-ENAMINE INTERMEDIATE OF SULBACTAM 著者 Malla, T.N, Schmidt, M. 登録日 2023-03-03 公開日 2023-09-20 実験手法 X-RAY DIFFRACTION (3.2 Å) 主引用文献 Heterogeneity in M. tuberculosis beta-lactamase inhibition by Sulbactam. Nat Commun, 14, 2023
6BHK	Phosphotriesterase variant R18deltaL7 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, Phosphotriesterase, ZINC ION 著者 Miton, C.M, Campbell, E.C, Jackson, C.J, Tokuriki, N. 登録日 2017-10-30 公開日 2019-01-23 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Phosphotriesterase variant R18deltaL7 To Be Published
8D8C	Crystal structure of hen egg white lysozyme at 300 Kelvin 分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ... 著者 Ribeiro, F.S, Lima, L.M.T.R. 登録日 2022-06-08 公開日 2023-05-10 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Linking B-factor and temperature-induced conformational transition. Biophys.Chem., 298, 2023
4QOF	Crystal structure of fmn quinone reductase 2 AT 1.55A 分子名称: FLAVIN MONONUCLEOTIDE, Ribosyldihydronicotinamide dehydrogenase [quinone], ZINC ION 著者 Serriere, J, Boutin, J.A, Isabet, T, Antoine, M, Ferry, G. 登録日 2014-06-20 公開日 2015-07-01 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 Crystal structure of FMN quinone reductase 2 at 1.55A To be Published
6BII	Crystal Structure of Pyrococcus yayanosii Glyoxylate Hydroxypyruvate Reductase in complex with NADP and malonate (re-refinement of 5AOW) 分子名称: GLYCEROL, Glyoxylate reductase, MALONATE ION, ... 著者 Lassalle, L, Shabalin, I.G, Girard, E, Minor, W. 登録日 2017-11-02 公開日 2018-01-17 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 New insights into the mechanism of substrates trafficking in Glyoxylate/Hydroxypyruvate reductases. Sci Rep, 6, 2016
5CN5	Ultrafast dynamics in myoglobin: 0 ps time delay 分子名称: CARBON MONOXIDE, Myoglobin, PROTOPORPHYRIN IX CONTAINING FE, ... 著者 Barends, T.R.M, Foucar, L, Ardevol, A, Nass, K.J, Aquila, A, Botha, S, Doak, R.B, Falahati, K, Hartmann, E, Hilpert, M, Heinz, M, Hoffmann, M.C, Koefinger, J, Koglin, J, Kovacsova, G, Liang, M, Milathianaki, D, Lemke, H.T, Reinstein, J, Roome, C.M, Shoeman, R.L, Williams, G.J, Burghardt, I, Hummer, G, Boutet, S, Schlichting, I. 登録日 2015-07-17 公開日 2015-09-16 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Direct observation of ultrafast collective motions in CO myoglobin upon ligand dissociation. Science, 350, 2015
8D5S	Crystal structure of hen egg white lysozyme at 100 Kelvin 分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ... 著者 Ribeiro, F.S, Lima, L.M.T.R. 登録日 2022-06-06 公開日 2023-05-10 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Linking B-factor and temperature-induced conformational transition. Biophys.Chem., 298, 2023
8D7S	Crystal structure of hen egg white lysozyme at 275 Kelvin 分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ... 著者 Ribeiro, F.S, Lima, L.M.T.R. 登録日 2022-06-07 公開日 2023-05-10 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Linking B-factor and temperature-induced conformational transition. Biophys.Chem., 298, 2023
5MCL	Radiation damage to GH7 Family Cellobiohydrolase from Daphnia pulex: Dose (DWD) 18.4 MGy 分子名称: Cellobiohydrolase CHBI, GLYCEROL, SULFATE ION 著者 Bury, C.S, McGeehan, J.E, Ebrahim, A, Garman, E.F. 登録日 2016-11-10 公開日 2017-01-11 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 OH cleavage from tyrosine: debunking a myth. J Synchrotron Radiat, 24, 2017
8D8Z	Crystal structure of ChoE N147A mutant in complex with thiocholine and chloride 分子名称: 2-(TRIMETHYLAMMONIUM)ETHYL THIOL, CHLORIDE ION, ChoE, ... 著者 Pham, V.D, Shi, R. 登録日 2022-06-09 公開日 2023-06-14 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.38 Å) 主引用文献 Crystal structures of bacterial acetylcholinesterase ChoE provide insights into the plasticity of catalytic Ser in regulating the active site geometry and the functional state of the SGNH hydrolases To be published
5MDH	CRYSTAL STRUCTURE OF TERNARY COMPLEX OF PORCINE CYTOPLASMIC MALATE DEHYDROGENASE ALPHA-KETOMALONATE AND TNAD AT 2.4 ANGSTROMS RESOLUTION 分子名称: ALPHA-KETOMALONIC ACID, MALATE DEHYDROGENASE, NICOTINAMIDE-ADENINE-DINUCLEOTIDE 著者 Chapman, A.D.M, Cortes, A, Dafforn, T.R, Clarke, A.R, Brady, R.L. 登録日 1998-10-08 公開日 1999-05-18 最終更新日 2023-08-09 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Structural basis of substrate specificity in malate dehydrogenases: crystal structure of a ternary complex of porcine cytoplasmic malate dehydrogenase, alpha-ketomalonate and tetrahydoNAD. J.Mol.Biol., 285, 1999
8GS3	Cryo-EM structure of human Neuroligin 3 分子名称: Neuroligin-3 著者 Zhang, H, Zhang, Z, Hou, M. 登録日 2022-09-04 公開日 2023-09-20 最終更新日 2024-04-03 実験手法 ELECTRON MICROSCOPY (3.9 Å) 主引用文献 Expression and structural analysis of human neuroligin 2 and neuroligin 3 implicated in autism spectrum disorders. Front Endocrinol, 13, 2022
8D8B	Crystal structure of hen egg white lysozyme at 275 Kelvin (Triplicate) 分子名称: CHLORIDE ION, GLYCEROL, Lysozyme C, ... 著者 Ribeiro, F.S, Lima, L.M.T.R. 登録日 2022-06-08 公開日 2023-05-10 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Linking B-factor and temperature-induced conformational transition. Biophys.Chem., 298, 2023
8AMO	Crystal structure of M. tuberculosis CYP143 分子名称: CHLORIDE ION, GLYCEROL, PROTOPORPHYRIN IX CONTAINING FE, ... 著者 Bukhdruker, S, Varaksa, T, Grudo, A, Marin, E, Kapranov, I, Shevtsov, M, Gilep, A, Strushkevich, N, Borshchevskiy, V. 登録日 2022-08-03 公開日 2023-02-15 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Structural insights into 3Fe-4S ferredoxins diversity in M. tuberculosis highlighted by a first redox complex with P450. Front Mol Biosci, 9, 2022
8D91	Crystal structure of ChoE in complex with acetate and tetraethylammonium (TEA) 分子名称: ACETATE ION, ChoE, TETRAETHYLAMMONIUM ION 著者 Pham, V.D, Shi, R. 登録日 2022-06-09 公開日 2023-06-14 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.49 Å) 主引用文献 Crystal structures of bacterial acetylcholinesterase ChoE provide insights into the plasticity of catalytic Ser in regulating the active site geometry and the functional state of the SGNH hydrolases To be published
8AMQ	Crystal structure of the complex CYP143-FdxE from M. tuberculosis 分子名称: FE3-S4 CLUSTER, NICKEL (II) ION, PROTOPORPHYRIN IX CONTAINING FE, ... 著者 Bukhdruker, S, Varaksa, T, Smolskaya, S, Marin, E, Kapranov, I, Kovalev, K, Gilep, A, Strushkevich, N, Borshchevskiy, V. 登録日 2022-08-03 公開日 2023-02-15 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Structural insights into 3Fe-4S ferredoxins diversity in M. tuberculosis highlighted by a first redox complex with P450. Front Mol Biosci, 9, 2022
5TVY	Computationally Designed Fentanyl Binder - Fen49 分子名称: 3,6,9,12,15,18,21,24,27-NONAOXANONACOSANE-1,29-DIOL, Endo-1,4-beta-xylanase A 著者 Bick, M.J, Greisen, P.J, Morey, K.J, Antunes, M.S, La, D, Sankaran, B, Reymond, L, Johnsson, K, Medford, J.I, Baker, D. 登録日 2016-11-10 公開日 2017-10-04 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1 Å) 主引用文献 Computational design of environmental sensors for the potent opioid fentanyl. Elife, 6, 2017
1AHD	DETERMINATION OF THE NMR SOLUTION STRUCTURE OF AN ANTENNAPEDIA HOMEODOMAIN-DNA COMPLEX 分子名称: DNA (5'-D(*CP*TP*CP*TP*AP*AP*TP*GP*GP*CP*TP*TP*TP*C)-3'), DNA (5'-D(*GP*AP*AP*AP*GP*CP*CP*AP*TP*TP*AP*GP*AP*G)-3'), Homeotic protein antennapedia 著者 Billeter, M, Qian, Y.Q, Otting, G, Muller, M, Gehring, W.J, Wuthrich, K. 登録日 1993-04-02 公開日 1993-10-31 最終更新日 2024-04-10 実験手法 SOLUTION NMR 主引用文献 Determination of the nuclear magnetic resonance solution structure of an Antennapedia homeodomain-DNA complex. J.Mol.Biol., 234, 1993
3P9T	SmeT-Triclosan complex 分子名称: Repressor, SULFATE ION, TRICLOSAN 著者 Hernandez, A, Ruiz, F.M, Romero, A, Martinez, J.L. 登録日 2010-10-18 公開日 2011-08-10 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.02 Å) 主引用文献 The Binding of Triclosan to SmeT, the Repressor of the Multidrug Efflux Pump SmeDEF, Induces Antibiotic Resistance in Stenotrophomonas maltophilia. Plos Pathog., 7, 2011
8B0Q	Deinococcus radiodurans UvrC C-terminal half 分子名称: UvrABC system protein C 著者 Timmins, J, Stelter, M. 登録日 2022-09-08 公開日 2023-02-15 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Structural and functional insights into the activation of the dual incision activity of UvrC, a key player in bacterial NER. Nucleic Acids Res., 51, 2023
8G96	Adenylation domain structure from NRPS-like Delta-Poly-L-Ornithine synthetase (L-Ornithine bound) 分子名称: Dimodular nonribosomal peptide synthase, GLYCEROL, L-ornithine 著者 Patel, K.D, Gulick, A.M. 登録日 2023-02-21 公開日 2023-10-04 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structural and functional insights into delta-poly-L-ornithine polymer biosynthesis from Acinetobacter baumannii. Commun Biol, 6, 2023

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