6XQT

Room-temperature X-ray Crystal structure of SARS-CoV-2 main protease in complex with Narlaprevir

6XQT の概要

• エントリーDOI: 10.2210/pdb6xqt/pdb
• 分子名称: 3C-like proteinase, (1R,2S,5S)-3-[N-({1-[(tert-butylsulfonyl)methyl]cyclohexyl}carbamoyl)-3-methyl-L-valyl]-N-{(1S)-1-[(1R)-2-(cyclopropylamino)-1-hydroxy-2-oxoethyl]pentyl}-6,6-dimethyl-3-azabicyclo[3.1.0]hexane-2-carboxamide (3 entities in total)
• 機能のキーワード: 3c like proteinase, viral protein, viral protein-hydrolase complex, viral protein/hydrolase
• 由来する生物種: Severe acute respiratory syndrome coronavirus 2 (2019-nCoV)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 69071.05

構造登録者

Kneller, D.W.,Kovalevsky, A.,Coates, L. (登録日: 2020-07-10, 公開日: 2020-07-22, 最終更新日: 2023-10-18)

• 主引用文献: Kneller, D.W.,Galanie, S.,Phillips, G.,O'Neill, H.M.,Coates, L.,Kovalevsky, A.; Malleability of the SARS-CoV-2 3CL M pro Active-Site Cavity Facilitates Binding of Clinical Antivirals.; Structure, 28:1313-, 2020; PubMed: 33152262; DOI: 10.1016/j.str.2020.10.007

実験手法

X-RAY DIFFRACTION (2.3 Å)