PDB: 37997 件ウェブページステータス検索Chemie searchBIRD

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5LAT	HIF prolyl hydroxylase 2 (PHD2/EGLN1) P317R variant in complex with Mn(II) and N-[(1-chloro-4-hydroxyisoquinolin-3-yl)carbonyl]glycine (IOX3/UN9) 分子名称: BICARBONATE ION, Egl nine homolog 1, GLYCEROL, ... 著者 Chowdhury, R, Schofield, C.J. 登録日 2016-06-15 公開日 2016-08-31 最終更新日 2024-10-16 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structural basis for oxygen degradation domain selectivity of the HIF prolyl hydroxylases. Nat Commun, 7, 2016
6NU7	Structure of sucrose-6-phosphate hydrolase from Lactobacillus gasseri 分子名称: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, SODIUM ION, ... 著者 Lima, M.Z.T, Muniz, J.R.C. 登録日 2019-01-31 公開日 2020-02-05 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structure of sucrose-6-phosphate hydrolase from Lactobacillus gasseri To Be Published
5LBH	Crystal structure of Helicobacter cinaedi CAIP 分子名称: CAIP, FE (III) ION 著者 Zanotti, G, Valesse, F, Codolo, G, De Bernard, M. 登録日 2016-06-16 公開日 2017-04-26 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.553 Å) 主引用文献 The Helicobacter cinaedi antigen CAIP participates in atherosclerotic inflammation by promoting the differentiation of macrophages in foam cells. Sci Rep, 7, 2017
5LBW	Structure of the human quinone reductase 2 (NQO2) in complex with volitinib 分子名称: FLAVIN-ADENINE DINUCLEOTIDE, Ribosyldihydronicotinamide dehydrogenase [quinone], ZINC ION, ... 著者 Schneider, S, Medard, G, Kuester, B. 登録日 2016-06-17 公開日 2017-11-29 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 The target landscape of clinical kinase drugs. Science, 358, 2017
7NPX	Thioredoxin glutathione reductase from Schistosoma mansoni in complex with 3-(3-Methoxyquinoxalin-2-yl)propanoic acid at 24 hours of soaking 分子名称: 3-(3-methoxyquinoxalin-2-yl)propanoic acid, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ... 著者 Fata, F, Silvestri, I, Williams, D.L, Angelucci, F. 登録日 2021-02-28 公開日 2021-05-19 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Probing the Surface of a Parasite Drug Target Thioredoxin Glutathione Reductase Using Small Molecule Fragments. Acs Infect Dis., 7, 2021
5AHF	Crystal structure of Salmonella enterica HisA D7N with ProFAR 分子名称: 1-(5-phosphoribosyl)-5-[(5-phosphoribosylamino)methylideneamino] imidazole-4-carboxamide isomerase, GLYCEROL, [(2R,3S,4R,5R)-5-[4-aminocarbonyl-5-[(E)-[[(2R,3R,4S,5R)-3,4-bis(oxidanyl)-5-(phosphonooxymethyl)oxolan-2-yl]amino]methylideneamino]imidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate 著者 Soderholm, A, Guo, X, Newton, M.S, Evans, G.B, Nasvall, J, Patrick, W.M, Selmer, M. 登録日 2015-02-05 公開日 2015-09-02 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.201 Å) 主引用文献 Two-Step Ligand Binding in a Beta/Alpha8 Barrel Enzyme -Substrate-Bound Structures Shed New Light on the Catalytic Cycle of Hisa J.Biol.Chem., 290, 2015
8USK	Crystal Structure of Kemp Eliminase HG185 in unbound state, 280 K 分子名称: Kemp eliminase 著者 Seifinoferest, B. 登録日 2023-10-27 公開日 2023-12-06 最終更新日 2024-10-16 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Design of Efficient Artificial Enzymes Using Crystallographically Enhanced Conformational Sampling. J.Am.Chem.Soc., 146, 2024
6NY6	Structure of dimeric Escherichia coli toxin YoeB bound to the Thermus thermophilus 30S ribosome 分子名称: 16S rRNA, 30S ribosomal protein S10, 30S ribosomal protein S11, ... 著者 Pavelich, I.J, Hoffer, E.D, Maehigashi, T, Dunham, C.M. 登録日 2019-02-11 公開日 2019-08-21 最終更新日 2024-10-30 実験手法 X-RAY DIFFRACTION (3.74 Å) 主引用文献 Monomeric YoeB toxin retains RNase activity but adopts an obligate dimeric form for thermal stability. Nucleic Acids Res., 47, 2019
8USE	Crystal Structure of Kemp Eliminase HG649 in unbound state, 280 K 分子名称: Kemp eliminase 著者 Seifinoferest, B. 登録日 2023-10-27 公開日 2023-12-06 最終更新日 2024-06-19 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 Design of Efficient Artificial Enzymes Using Crystallographically Enhanced Conformational Sampling. J.Am.Chem.Soc., 146, 2024
5A5W	Crystal structure of Salmonella enterica HisA D7N D176A with ProFAR 分子名称: 1-(5-phosphoribosyl)-5-[(5-phosphoribosylamino)methylideneamino] imidazole-4-carboxamide isomerase, [(2R,3S,4R,5R)-5-[4-aminocarbonyl-5-[(E)-[[(2R,3R,4S,5R)-3,4-bis(oxidanyl)-5-(phosphonooxymethyl)oxolan-2-yl]amino]methylideneamino]imidazol-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methyl dihydrogen phosphate 著者 Soderholm, A, Guo, X, Newton, M.S, Evans, G.B, Nasvall, J, Patrick, W.M, Selmer, M. 登録日 2015-06-23 公開日 2015-09-02 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Two-Step Ligand Binding in a Beta/Alpha8 Barrel Enzyme -Substrate-Bound Structures Shed New Light on the Catalytic Cycle of Hisa J.Biol.Chem., 290, 2015
8USI	Crystal Structure of Kemp Eliminase HG198 in unbound state, 280 K 分子名称: Kemp eliminase 著者 Seifinoferest, B. 登録日 2023-10-27 公開日 2023-12-06 最終更新日 2024-06-19 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Design of Efficient Artificial Enzymes Using Crystallographically Enhanced Conformational Sampling. J.Am.Chem.Soc., 146, 2024
8USL	Crystal Structure of Kemp Eliminase HG185 with bound transition state analogue, 280 K 分子名称: 6-NITROBENZOTRIAZOLE, Kemp eliminase 著者 Seifinoferest, B. 登録日 2023-10-27 公開日 2023-12-06 最終更新日 2024-10-23 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 Design of Efficient Artificial Enzymes Using Crystallographically Enhanced Conformational Sampling. J.Am.Chem.Soc., 146, 2024
8UQO	PLCb3-Gbg-Gaq complex on membranes 分子名称: 1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase beta-3, CALCIUM ION, GUANOSINE-5'-DIPHOSPHATE, ... 著者 Falzone, M.E, MacKinnon, R. 登録日 2023-10-24 公開日 2023-12-06 実験手法 ELECTRON MICROSCOPY (3.37 Å) 主引用文献 The mechanism of G alpha q regulation of PLC beta 3 -catalyzed PIP2 hydrolysis. Proc.Natl.Acad.Sci.USA, 120, 2023
8USH	Crystal Structure of Kemp Eliminase HG630 with bound transition state analogue, 280 K 分子名称: 6-NITROBENZOTRIAZOLE, Kemp eliminase 著者 Seifinoferest, B. 登録日 2023-10-27 公開日 2023-12-06 最終更新日 2024-10-16 実験手法 X-RAY DIFFRACTION (1.32 Å) 主引用文献 Design of Efficient Artificial Enzymes Using Crystallographically Enhanced Conformational Sampling. J.Am.Chem.Soc., 146, 2024
8USJ	Crystal Structure of Kemp Eliminase HG198 with bound transition state analogue, 280 K 分子名称: 6-NITROBENZOTRIAZOLE, Kemp eliminase 著者 Seifinoferest, B. 登録日 2023-10-27 公開日 2023-12-06 最終更新日 2024-06-19 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Design of Efficient Artificial Enzymes Using Crystallographically Enhanced Conformational Sampling. J.Am.Chem.Soc., 146, 2024
8UQN	PLCb3-Gaq complex on membranes 分子名称: 1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase beta-3, CALCIUM ION, GUANOSINE-5'-DIPHOSPHATE, ... 著者 Falzone, M.E, MacKinnon, R. 登録日 2023-10-24 公開日 2023-12-06 実験手法 ELECTRON MICROSCOPY (3.4 Å) 主引用文献 The mechanism of G alpha q regulation of PLC beta 3 -catalyzed PIP2 hydrolysis. Proc.Natl.Acad.Sci.USA, 120, 2023
8USF	Crystal Structure of Kemp Eliminase HG649 with bound transition state analogue, 280 K 分子名称: 6-NITROBENZOTRIAZOLE, Kemp eliminase 著者 Seifinoferest, B. 登録日 2023-10-27 公開日 2023-12-06 最終更新日 2024-10-30 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Design of Efficient Artificial Enzymes Using Crystallographically Enhanced Conformational Sampling. J.Am.Chem.Soc., 146, 2024
8USG	Crystal Structure of Kemp Eliminase HG630 in unbound state, 280 K 分子名称: Kemp eliminase, SULFATE ION 著者 Seifinoferest, B. 登録日 2023-10-27 公開日 2023-12-06 最終更新日 2024-11-06 実験手法 X-RAY DIFFRACTION (1.37 Å) 主引用文献 Design of Efficient Artificial Enzymes Using Crystallographically Enhanced Conformational Sampling. J.Am.Chem.Soc., 146, 2024
7M40	Discovery of small molecule antagonists of human Retinoblastoma Binding Protein 4 (RBBP4) 分子名称: Histone-binding protein RBBP4, N~3~-{4-[3-(dimethylamino)pyrrolidin-1-yl]-6,7-dimethoxyquinazolin-2-yl}-N~1~,N~1~-dimethylpropane-1,3-diamine 著者 Perveen, S, Dong, A, Tempel, W, Zepeda-Velazquez, C, Abbey, M, McLeod, D, Marcellus, R, Mohammed, M, Ensan, D, Panagopoulos, D, Trush, V, Gibson, E, Brown, P.J, Arrowsmith, C.H, Schapira, M, Al-awar, R, Vedadi, M, Structural Genomics Consortium (SGC) 登録日 2021-03-19 公開日 2021-05-12 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.88 Å) 主引用文献 Discovery of small molecule antagonists of human Retinoblastoma Binding Protein 4 (RBBP4) To Be Published
9C1T	Crystal structure of integrin beta-3 tail bound to the FERM-folded talin head domain with a D397R mutation 分子名称: Integrin beta-3, Talin-1, SULFATE ION 著者 Wu, J, Gao, T. 登録日 2024-05-29 公開日 2025-04-23 最終更新日 2025-05-14 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Molecular basis of beta 2 integrin activation by talin unveils subunit-specific mechanisms of integrin signaling. Cell Rep, 44, 2025
5LIE	Crystal structure of Mycobacterium tuberculosis CYP126A1 in complex with imidazole 分子名称: IMIDAZOLE, PROTOPORPHYRIN IX CONTAINING FE, Putative cytochrome P450 126 著者 Levy, C, Munro, A.W, Leys, D. 登録日 2016-07-14 公開日 2016-12-21 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.799 Å) 主引用文献 Structural Characterization and Ligand/Inhibitor Identification Provide Functional Insights into the Mycobacterium tuberculosis Cytochrome P450 CYP126A1. J. Biol. Chem., 292, 2017
5LDX	Structure of mammalian respiratory Complex I, class3. 分子名称: Acyl carrier protein, mitochondrial, FE2/S2 (INORGANIC) CLUSTER, ... 著者 Vinothkumar, K.R, Zhu, J, Hirst, J. 登録日 2016-06-28 公開日 2016-09-14 最終更新日 2024-11-13 実験手法 ELECTRON MICROSCOPY (5.6 Å) 主引用文献 Structure of mammalian respiratory complex I. Nature, 536, 2016
5LFD	Crystal structure of allantoin racemase from Pseudomonas fluorescens AllR 分子名称: Allantoin racemase 著者 Cendron, l, Zanotti, G, Percudani, R, Ramazzina, I, Puggioni, V, Maccacaro, E, Liuzzi, A, Secchi, A. 登録日 2016-07-01 公開日 2017-05-10 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.15 Å) 主引用文献 The Structure and Function of a Microbial Allantoin Racemase Reveal the Origin and Conservation of a Catalytic Mechanism. Biochemistry, 55, 2016
1N68	Copper bound to the Multicopper Oxidase CueO 分子名称: Blue copper oxidase cueO, COPPER (II) ION, CU-CL-CU LINKAGE 著者 Roberts, S.A, Wildner, G.F, Grass, G, Weichsel, A, Ambrus, A, Rensing, C, Montfort, W.R. 登録日 2002-11-08 公開日 2003-06-24 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 A Labile Regulatory Copper Ion Lies Near the T1 Copper Site in the Multicopper Oxidase CueO. J.Biol.Chem., 278, 2003
7LX7	T4 lysozyme mutant L99A 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 4-(2-phenylethoxy)phenol, Lysozyme 著者 Kamenik, A.S, Singh, I, Lak, P, Balius, T.E, Liedl, K.R, Shoichet, B.K. 登録日 2021-03-03 公開日 2021-05-19 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.05 Å) 主引用文献 Energy penalties enhance flexible receptor docking in a model cavity. Proc.Natl.Acad.Sci.USA, 118, 2021

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