| タイトル | Turnover-Dependent Covalent Inactivation of Staphylococcus aureus Coenzyme A-Disulfide Reductase by Coenzyme A-Mimetics: Mechanistic and Structural Insights. |
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| ジャーナル・号・ページ | Biochemistry, Vol. 51, Page 7699-7711, Year 2012 |
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| 掲載日 | 2012年4月11日 (構造データの登録日) |
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著者 | Wallace, B.D. / Edwards, J.S. / Wallen, J.R. / Moolman, W.J. / van der Westhuyzen, R. / Strauss, E. / Redinbo, M.R. / Claiborne, A. |
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リンク | Biochemistry / PubMed:22954034 |
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| 手法 | X線回折 |
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| 解像度 | 1.5 - 2.39 Å |
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| 構造データ | PDB-4em3: Crystal Structure of Staphylococcus aureus bound with the covalent inhibitor MeVS-CoA 手法: X-RAY DIFFRACTION / 解像度: 1.977 Å PDB-4em4: Crystal Structure of Staphylococcus aureus bound with the covalent inhibitor Pethyl-VS-CoA 手法: X-RAY DIFFRACTION / 解像度: 1.821 Å PDB-4emw: Crystal Structure of Staphylococcus aureus bound with the covalent inhibitor EtVC-CoA 手法: X-RAY DIFFRACTION / 解像度: 2.39 Å PDB-4eqr: Crystal structure of the Y361F mutant of Staphylococcus aureus CoADR 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-4eqs: Crystal structure of the Y419F mutant of Staphylococcus aureus CoADR 手法: X-RAY DIFFRACTION / 解像度: 1.5 Å PDB-4eqw: Crystal Structure of the Y361F, Y419F Mutant of Staphylococcus aureus CoADR 手法: X-RAY DIFFRACTION / 解像度: 1.5 Å PDB-4eqx: Crystal Structure of the C43S Mutant of Staphylococcus aureus CoADR 手法: X-RAY DIFFRACTION / 解像度: 1.7 Å |
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| 化合物 | ChemComp-CA6: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(3R)-2,2-dimethyl-4-[[3-(4-methylsulfonylbutylamino)-3-oxidanylidene-propyl]amino]-3-oxidanyl-4-oxidanylidene-butyl] hydrogen phosphate
ChemComp-CA8: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(3R)-2,2-dimethyl-3-oxidanyl-4-oxidanylidene-4-[[3-oxidanylidene-3-[4-(phenylsulfonyl)butylamino]propyl]amino]butyl] hydrogen phosphate
ChemComp-CAJ: ethyl 5-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-oxidanyl-3-phosphonooxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-3,3-dimethyl-2-oxidanyl-butanoyl]amino]propanoylamino]pentanoate
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| 由来 |  staphylococcus aureus subsp. aureus (黄色ブドウ球菌)
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キーワード | OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR / OXIDOREDUCTASE-OXIDOREDUCTASE INHIBITOR COMPLEX / OXIDOREDUCTASE |
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