8HHU

Crystal structure of the SARS-CoV-2 main protease in complex with SY110

8HHU の概要

• エントリーDOI: 10.2210/pdb8hhu/pdb
• 分子名称: 3C-like proteinase nsp5, (1~{R})-3,3-bis(fluoranyl)-~{N}-[(2~{R})-3-methoxy-1-oxidanylidene-1-[[(2~{R},3~{S})-3-oxidanyl-4-oxidanylidene-1-phenyl-4-(1,3-thiazol-2-ylmethylamino)butan-2-yl]amino]propan-2-yl]cyclohexane-1-carboxamide (3 entities in total)
• 機能のキーワード: severe acute respiratory syndrome coronavirus 2, main protease, viral protein
• 由来する生物種: Severe acute respiratory syndrome coronavirus 2
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 34405.18

構造登録者

Zeng, R.,Xie, L.W.,Huang, C.,Wang, K.,Liu, Y.Z.,Yang, S.Y.,Lei, J. (登録日: 2022-11-17, 公開日: 2023-03-29, 最終更新日: 2023-11-29)

• 主引用文献: Huang, C.,Shuai, H.,Qiao, J.,Hou, Y.,Zeng, R.,Xia, A.,Xie, L.,Fang, Z.,Li, Y.,Yoon, C.,Huang, Q.,Hu, B.,You, J.,Quan, B.,Zhao, X.,Guo, N.,Zhang, S.,Ma, R.,Zhang, J.,Wang, Y.,Yang, R.,Zhang, S.,Nan, J.,Xu, H.,Wang, F.,Lei, J.,Chu, H.,Yang, S.; A new generation M pro inhibitor with potent activity against SARS-CoV-2 Omicron variants.; Signal Transduct Target Ther, 8:128-128, 2023; PubMed: 36928316; DOI: 10.1038/s41392-023-01392-w

実験手法

X-RAY DIFFRACTION (2.258 Å)