6LZE

The crystal structure of COVID-19 main protease in complex with an inhibitor 11a

6LZE の概要

• エントリーDOI: 10.2210/pdb6lze/pdb
• 関連するBIRD辞書のPRD_ID: PRD_002347
• 分子名称: 3C-like proteinase, DIMETHYL SULFOXIDE, ~{N}-[(2~{S})-3-cyclohexyl-1-oxidanylidene-1-[[(2~{S})-1-oxidanylidene-3-[(3~{S})-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]propan-2-yl]-1~{H}-indole-2-carboxamide, ... (4 entities in total)
• 機能のキーワード: protease, viral protein
• 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: 1
• 化学式量合計: 34214.22

構造登録者

Zhang, B.,Zhang, Y.,Jing, Z.,Liu, X.,Yang, H.,Liu, H.,Rao, Z.,Jiang, H. (登録日: 2020-02-19, 公開日: 2020-04-29, 最終更新日: 2023-11-29)

• 主引用文献: Dai, W.,Zhang, B.,Jiang, X.M.,Su, H.,Li, J.,Zhao, Y.,Xie, X.,Jin, Z.,Peng, J.,Liu, F.,Li, C.,Li, Y.,Bai, F.,Wang, H.,Cheng, X.,Cen, X.,Hu, S.,Yang, X.,Wang, J.,Liu, X.,Xiao, G.,Jiang, H.,Rao, Z.,Zhang, L.K.,Xu, Y.,Yang, H.,Liu, H.; Structure-based design of antiviral drug candidates targeting the SARS-CoV-2 main protease.; Science, 368:1331-1335, 2020; PubMed: 32321856; DOI: 10.1126/science.abb4489

実験手法

X-RAY DIFFRACTION (1.505 Å)