7JUN

Joint neutron/X-ray structure of SARS-CoV-2 3CL Mpro at room temperature

7JUN の概要

• エントリーDOI: 10.2210/pdb7jun/pdb
• 分子名称: 3C-like proteinase (2 entities in total)
• 機能のキーワード: neutron crystallography, room temperature, sars-cov-2, main protease, 3cl mpro, protonation state, hydrogen bond, enzyme mechanism, drug design, hydrolase
• 由来する生物種: Severe acute respiratory syndrome coronavirus 2 (2019-nCoV, SARS-CoV-2, COVID-19 virus)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 33825.55

構造登録者

Kovalevsky, A.,Kneller, D.W.,Coates, L. (登録日: 2020-08-20, 公開日: 2020-09-02, 最終更新日: 2024-04-03)

• 主引用文献: Kneller, D.W.,Phillips, G.,Weiss, K.L.,Pant, S.,Zhang, Q.,O'Neill, H.M.,Coates, L.,Kovalevsky, A.; Unusual zwitterionic catalytic site of SARS-CoV-2 main protease revealed by neutron crystallography.; J.Biol.Chem., 295:17365-17373, 2020; PubMed: 33060199; DOI: 10.1074/jbc.AC120.016154

実験手法

NEUTRON DIFFRACTION (2.5 Å)
X-RAY DIFFRACTION (2.3 Å)