9FCQ
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![BU of 9fcq by Molmil](/molmil-images/mine/9fcq) | CysG(N-16)-H122A mutant in complex with SAH from Kitasatospora cystarginea | 分子名称: | 1,2-ETHANEDIOL, CALCIUM ION, DI(HYDROXYETHYL)ETHER, ... | 著者 | Kuttenlochner, W, Beller, P, Kaysser, L, Groll, M. | 登録日 | 2024-05-15 | 公開日 | 2024-08-21 | 実験手法 | X-RAY DIFFRACTION (1.4 Å) | 主引用文献 | Deciphering the SAM- and Metal-Dependent Mechanism of O-Methyltransferases in Cystargolide and Belactosin Biosynthesis: A Structure-Activity Relationship Study. J.Biol.Chem., 2024
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1VP5
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7RPD
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![BU of 7rpd by Molmil](/molmil-images/mine/7rpd) | X-ray crystal structure of OXA-24/40 V130D in complex with ertapenem | 分子名称: | (4R,5S)-3-({(3S,5S)-5-[(3-carboxyphenyl)carbamoyl]pyrrolidin-3-yl}sulfanyl)-5-[(1S,2R)-1-formyl-2-hydroxypropyl]-4-methyl-4,5-dihydro-1H-pyrrole-2-carboxylic acid, BICARBONATE ION, Beta-lactamase, ... | 著者 | Powers, R.A, Mitchell, J.M, June, C.M. | 登録日 | 2021-08-03 | 公開日 | 2022-07-06 | 最終更新日 | 2023-10-18 | 実験手法 | X-RAY DIFFRACTION (1.95 Å) | 主引用文献 | Conformational flexibility in carbapenem hydrolysis drives substrate specificity of the class D carbapenemase OXA-24/40. J.Biol.Chem., 298, 2022
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5GR2
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9FCU
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![BU of 9fcu by Molmil](/molmil-images/mine/9fcu) | |
1VR6
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![BU of 1vr6 by Molmil](/molmil-images/mine/1vr6) | |
7QZ2
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![BU of 7qz2 by Molmil](/molmil-images/mine/7qz2) | Crystal structure of GacS D1 domain in complex with BeF3- | 分子名称: | BERYLLIUM TRIFLUORIDE ION, CADMIUM ION, Histidine kinase, ... | 著者 | Fadel, F, Bassim, V, Botzanowski, T, Francis, V.I, Legrand, P, Porter, S.L, Bourne, Y, Cianferani, S, Vincent, F. | 登録日 | 2022-01-30 | 公開日 | 2022-07-06 | 最終更新日 | 2024-02-07 | 実験手法 | X-RAY DIFFRACTION (1.87 Å) | 主引用文献 | Insights into the atypical autokinase activity of the Pseudomonas aeruginosa GacS histidine kinase and its interaction with RetS. Structure, 30, 2022
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9FCY
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![BU of 9fcy by Molmil](/molmil-images/mine/9fcy) | CysG(N-16)-R21K mutant in complex with SAH from Kitasatospora cystarginea | 分子名称: | ADENINE, CALCIUM ION, SAM-dependent methyltransferase | 著者 | Kuttenlochner, W, Beller, P, Kaysser, L, Groll, M. | 登録日 | 2024-05-16 | 公開日 | 2024-08-21 | 実験手法 | X-RAY DIFFRACTION (1.85 Å) | 主引用文献 | Deciphering the SAM- and Metal-Dependent Mechanism of O-Methyltransferases in Cystargolide and Belactosin Biosynthesis: A Structure-Activity Relationship Study. J.Biol.Chem., 2024
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7MX5
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![BU of 7mx5 by Molmil](/molmil-images/mine/7mx5) | Crystal structure of TolB from Acinetobacter baumannii | 分子名称: | Tol-Pal system protein TolB | 著者 | Stogios, P.J, Evdokimova, E, Endres, M, Savchenko, A, Joachimiak, A, Satchell, K.J.F, Center for Structural Genomics of Infectious Diseases (CSGID) | 登録日 | 2021-05-18 | 公開日 | 2021-05-26 | 最終更新日 | 2023-10-18 | 実験手法 | X-RAY DIFFRACTION (2.42 Å) | 主引用文献 | Crystal structure of TolB from Acinetobacter baumannii To Be Published
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7R6A
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1VRG
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![BU of 1vrg by Molmil](/molmil-images/mine/1vrg) | |
7R69
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3LHP
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7RPB
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![BU of 7rpb by Molmil](/molmil-images/mine/7rpb) | X-ray crystal structure of OXA-24/40 V130D in complex with meropenem | 分子名称: | (4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-d ihydro-1H-pyrrole-2-carboxylic acid, BICARBONATE ION, Beta-lactamase | 著者 | Powers, R.A, Mitchell, J.M, June, C.M. | 登録日 | 2021-08-03 | 公開日 | 2022-07-06 | 最終更新日 | 2023-10-18 | 実験手法 | X-RAY DIFFRACTION (1.97 Å) | 主引用文献 | Conformational flexibility in carbapenem hydrolysis drives substrate specificity of the class D carbapenemase OXA-24/40. J.Biol.Chem., 298, 2022
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6DGL
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7R8R
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![BU of 7r8r by Molmil](/molmil-images/mine/7r8r) | Physachenolide C with Bromodomain (BRD3-BD1) | 分子名称: | Bromodomain-containing protein 3, Physachenolide C | 著者 | Fromme, R, Sivinski, J, Zerio, C, Gunatilaka, A.A.L, Chapman, E. | 登録日 | 2021-06-27 | 公開日 | 2022-09-21 | 最終更新日 | 2023-10-25 | 実験手法 | X-RAY DIFFRACTION (1.8 Å) | 主引用文献 | Physachenolide C is a Potent, Selective BET Inhibitor. J.Med.Chem., 66, 2023
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6DGY
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![BU of 6dgy by Molmil](/molmil-images/mine/6dgy) | Crystal structure of HIV-1 Protease NL4-3 WT in complex with UMass1 | 分子名称: | (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(1S,2R)-3-{[(4-aminophenyl)sulfonyl][(2S)-2-methylbutyl]amino}-1-benzyl-2-hydroxypropyl]carbamate, Protease, SULFATE ION | 著者 | Lockbaum, G.J, Schiffer, C.A. | 登録日 | 2018-05-18 | 公開日 | 2018-12-26 | 最終更新日 | 2023-10-11 | 実験手法 | X-RAY DIFFRACTION (1.954 Å) | 主引用文献 | Structural Adaptation of Darunavir Analogues against Primary Mutations in HIV-1 Protease. ACS Infect Dis, 5, 2019
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6DH7
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![BU of 6dh7 by Molmil](/molmil-images/mine/6dh7) | Crystal structure of HIV-1 Protease NL4-3 I50V Mutant in complex with UMass1 | 分子名称: | (3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl [(1S,2R)-3-{[(4-aminophenyl)sulfonyl][(2S)-2-methylbutyl]amino}-1-benzyl-2-hydroxypropyl]carbamate, Protease, SULFATE ION | 著者 | Lockbaum, G.J, Schiffer, C.A. | 登録日 | 2018-05-18 | 公開日 | 2018-12-26 | 最終更新日 | 2023-10-11 | 実験手法 | X-RAY DIFFRACTION (1.997 Å) | 主引用文献 | Structural Adaptation of Darunavir Analogues against Primary Mutations in HIV-1 Protease. ACS Infect Dis, 5, 2019
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3LL9
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1W2S
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![BU of 1w2s by Molmil](/molmil-images/mine/1w2s) | Solution structure of CR2 SCR 1-2 in its complex with C3d by X-ray scattering | 分子名称: | COMPLEMENT C3 PRECURSOR, COMPLEMENT RECEPTOR TYPE 2 PRECURSOR, | 著者 | Gilbert, H.E, Hannan, J.P, Holers, V.M, Perkins, S.J. | 登録日 | 2004-07-08 | 公開日 | 2005-09-29 | 最終更新日 | 2024-05-08 | 実験手法 | SOLUTION SCATTERING | 主引用文献 | Solution Structure of the Complex between Cr2 Scr 1-2 and C3D of Human Complement: An X-Ray Scattering and Sedimentation Modelling Study. J.Mol.Biol., 346, 2005
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6DIC
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![BU of 6dic by Molmil](/molmil-images/mine/6dic) | D276G DNA polymerase beta substrate complex with templating cytosine and incoming Fapy-dGTP analog | 分子名称: | 1-[2-amino-5-(formylamino)-6-oxo-1,6-dihydropyrimidin-4-yl]-2,5-anhydro-1,3-dideoxy-6-O-[(R)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl]-D-ribo-hexitol, CALCIUM ION, CHLORIDE ION, ... | 著者 | Freudenthal, B.D, Smith, M.R, Wilson, S.H, Beard, W.A. | 登録日 | 2018-05-23 | 公開日 | 2019-01-30 | 最終更新日 | 2023-10-11 | 実験手法 | X-RAY DIFFRACTION (1.992 Å) | 主引用文献 | A guardian residue hinders insertion of a Fapy•dGTP analog by modulating the open-closed DNA polymerase transition. Nucleic Acids Res., 47, 2019
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7RP9
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![BU of 7rp9 by Molmil](/molmil-images/mine/7rp9) | X-ray crystal structure of OXA-24/40 V130D in complex with imipenem | 分子名称: | (2R,4S)-2-[(1S,2R)-1-carboxy-2-hydroxypropyl]-4-[(2-{[(Z)-iminomethyl]amino}ethyl)sulfanyl]-3,4-dihydro-2H-pyrrole-5-ca rboxylic acid, BICARBONATE ION, Beta-lactamase, ... | 著者 | Powers, R.A, Mitchell, J.M, June, C.M. | 登録日 | 2021-08-03 | 公開日 | 2022-07-06 | 最終更新日 | 2023-10-18 | 実験手法 | X-RAY DIFFRACTION (1.94 Å) | 主引用文献 | Conformational flexibility in carbapenem hydrolysis drives substrate specificity of the class D carbapenemase OXA-24/40. J.Biol.Chem., 298, 2022
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7RPA
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![BU of 7rpa by Molmil](/molmil-images/mine/7rpa) | X-ray crystal structure of OXA-24/40 K84D in complex with meropenem | 分子名称: | (4R,5S)-3-{[(3S,5S)-5-(dimethylcarbamoyl)pyrrolidin-3-yl]sulfanyl}-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-4,5-d ihydro-1H-pyrrole-2-carboxylic acid, BICARBONATE ION, Beta-lactamase, ... | 著者 | Powers, R.A, Mitchell, J.M, June, C.M. | 登録日 | 2021-08-03 | 公開日 | 2022-07-06 | 最終更新日 | 2023-10-18 | 実験手法 | X-RAY DIFFRACTION (2.27 Å) | 主引用文献 | Conformational flexibility in carbapenem hydrolysis drives substrate specificity of the class D carbapenemase OXA-24/40. J.Biol.Chem., 298, 2022
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1W2Z
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![BU of 1w2z by Molmil](/molmil-images/mine/1w2z) | PSAO and Xenon | 分子名称: | 2-acetamido-2-deoxy-beta-D-glucopyranose, AMINE OXIDASE, COPPER CONTAINING, ... | 著者 | Duff, A.P, Trambaiolo, D.M, Cohen, A.E, Ellis, P.J, Juda, G.A, Shepard, E.M, Langley, D.B, Dooley, D.M, Freeman, H.C, Guss, J.M. | 登録日 | 2004-07-11 | 公開日 | 2004-11-17 | 最終更新日 | 2023-12-13 | 実験手法 | X-RAY DIFFRACTION (2.24 Å) | 主引用文献 | Using Xenon as a Probe for Dioxygen-Binding Sites in Copper Amine Oxidases. J.Mol.Biol., 344, 2004
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3DD5
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![BU of 3dd5 by Molmil](/molmil-images/mine/3dd5) | Glomerella cingulata E600-cutinase complex | 分子名称: | Cutinase, DIETHYL PHOSPHONATE | 著者 | Nyon, M.P, Rice, D.W, Berrisford, J.M, Hounslow, A.M, Moir, A.J.G, Huang, H, Nathan, S, Mahadi, N.M, Farah Diba, A.B, Craven, C.J. | 登録日 | 2008-06-05 | 公開日 | 2008-11-18 | 最終更新日 | 2023-11-01 | 実験手法 | X-RAY DIFFRACTION (2.6 Å) | 主引用文献 | Catalysis by Glomerella cingulata Cutinase Requires Conformational Cycling between the Active and Inactive States of Its Catalytic Triad J.Mol.Biol., 385, 2009
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