8TPH

Synthesis, X-Ray Crystallographic and Biological Activities of Covalent, Non-Peptidic Inhibitors of SARS-CoV-2 Main Protease

8TPH の概要

• エントリーDOI: 10.2210/pdb8tph/pdb
• 分子名称: Non-structural protein 7, (3R)-N-(4-tert-butylphenyl)-N-[(1R)-2-(cyclohexylamino)-2-oxo-1-(pyridin-3-yl)ethyl]-3-hydroxybutanamide (3 entities in total)
• 機能のキーワード: non-peptidic inhibitors, inhibitors, sars-cov-2, main protease, mpro, viral protein, viral protein-inhibitor complex, viral protein/inhibitor
• 由来する生物種: Severe acute respiratory syndrome coronavirus 2 (2019-nCoV, SARS-CoV-2)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 34149.02

構造登録者

Chua, T.K.,Song, Y. (登録日: 2023-08-04, 公開日: 2024-01-24, 最終更新日: 2024-02-21)

• 主引用文献: Ashraf-Uz-Zaman, M.,Chua, T.K.,Li, X.,Yao, Y.,Moku, B.K.,Mishra, C.B.,Avadhanula, V.,Piedra, P.A.,Song, Y.; Design, Synthesis, X-ray Crystallography, and Biological Activities of Covalent, Non-Peptidic Inhibitors of SARS-CoV-2 Main Protease.; Acs Infect Dis., 10:715-731, 2024; PubMed: 38192109; DOI: 10.1021/acsinfecdis.3c00565

実験手法

X-RAY DIFFRACTION (1.52 Å)