7DPP
SARS-CoV-2 3CL protease (3CLpro) in complex with myricetin
Summary for 7DPP
Entry DOI | 10.2210/pdb7dpp/pdb |
Descriptor | 3C-like proteinase, 3,5,7-TRIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)-4H-CHROMEN-4-ONE (3 entities in total) |
Functional Keywords | sars-cov-2, 3clpro, inhibitor, complex, myricetin, viral protein |
Biological source | Severe acute respiratory syndrome coronavirus 2 (2019-nCoV) |
Total number of polymer chains | 1 |
Total formula weight | 33611.20 |
Authors | Su, H.X.,Zhao, W.F.,Xie, H.,Li, M.J.,Xu, Y.C. (deposition date: 2020-12-21, release date: 2021-05-12, Last modification date: 2023-11-29) |
Primary citation | Su, H.,Yao, S.,Zhao, W.,Zhang, Y.,Liu, J.,Shao, Q.,Wang, Q.,Li, M.,Xie, H.,Shang, W.,Ke, C.,Feng, L.,Jiang, X.,Shen, J.,Xiao, G.,Jiang, H.,Zhang, L.,Ye, Y.,Xu, Y. Identification of pyrogallol as a warhead in design of covalent inhibitors for the SARS-CoV-2 3CL protease. Nat Commun, 12:3623-3623, 2021 Cited by PubMed: 34131140DOI: 10.1038/s41467-021-23751-3 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.1 Å) |
Structure validation
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