7XRS

Crystal structure of SARS-Cov-2 main protease in complex with inhibitor YH-53

7XRS の概要

• エントリーDOI: 10.2210/pdb7xrs/pdb
• 分子名称: Replicase polyprotein 1a, N-[(2S)-1-[[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-4-methoxy-1H-indole-2-carboxamide (3 entities in total)
• 機能のキーワード: viral protein-inhibitor complex, viral protein/inhibitor
• 由来する生物種: Severe acute respiratory syndrome coronavirus 2
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 67449.02

構造登録者

Zhou, X.L.,Zhong, F.L.,Lin, C.,Zeng, P.,Zhang, J.,Li, J. (登録日: 2022-05-11, 公開日: 2022-12-21, 最終更新日: 2023-11-29)

• 主引用文献: Hu, X.,Lin, C.,Xu, Q.,Zhou, X.,Zeng, P.,McCormick, P.J.,Jiang, H.,Li, J.,Zhang, J.; Structural Basis for the Inhibition of Coronaviral Main Proteases by a Benzothiazole-Based Inhibitor.; Viruses, 14:-, 2022; PubMed: 36146880; DOI: 10.3390/v14092075

実験手法

X-RAY DIFFRACTION (1.93 Å)