タイトル | Anti-infective therapy using species-specific activators of Staphylococcus aureus ClpP. |
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ジャーナル・号・ページ | Nat Commun, Vol. 13, Page 6909-6909, Year 2022 |
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掲載日 | 2021年12月28日 (構造データの登録日) |
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著者 | Wei, B. / Zhang, T. / Wang, P. / Pan, Y. / Li, J. / Chen, W. / Zhang, M. / Ji, Q. / Wu, W. / Lan, L. ...Wei, B. / Zhang, T. / Wang, P. / Pan, Y. / Li, J. / Chen, W. / Zhang, M. / Ji, Q. / Wu, W. / Lan, L. / Gan, J. / Yang, C.G. |
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リンク | Nat Commun / PubMed:36376309 |
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手法 | X線回折 |
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解像度 | 1.9 - 2.15 Å |
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構造データ | PDB-7wgs: Structure of ClpP from Staphylococcus aureus in complex with (S)-ZG197 手法: X-RAY DIFFRACTION / 解像度: 2.11 Å PDB-7wh5: Crystal structure of human ClpP in complex with ZG180 手法: X-RAY DIFFRACTION / 解像度: 2.13 Å PDB-7wid: Crystal structure of Staphylococcus aureus ClpP in complex with ZG180 手法: X-RAY DIFFRACTION / 解像度: 1.9 Å PDB-7xbz: Crystal structure of Staphylococcus aureus ClpP in complex with R-ZG197 手法: X-RAY DIFFRACTION / 解像度: 2.15 Å |
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化合物 | ChemComp-9A2: (6S,9aS)-6-[(2R)-butan-2-yl]-8-[(1S)-1-naphthalen-1-ylethyl]-4,7-bis(oxidanylidene)-N-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide
ChemComp-9DF: (6S,9aS)-6-[(2S)-butan-2-yl]-8-(naphthalen-1-ylmethyl)-4,7-bis(oxidanylidene)-N-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide
ChemComp-D4E: (6S,9aS)-6-[(2S)-butan-2-yl]-8-[(1R)-1-naphthalen-1-ylethyl]-4,7-bis(oxidanylidene)-N-[4,4,4-tris(fluoranyl)butyl]-3,6,9,9a-tetrahydro-2H-pyrazino[1,2-a]pyrimidine-1-carboxamide
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由来 | - staphylococcus aureus (黄色ブドウ球菌)
- homo sapiens (ヒト)
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キーワード | HYDROLASE / ClpP / Staphyloccocus aureus / activator / protease |
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