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PDB: 1 results

8QDC
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BU of 8qdc by Molmil
Crystal structure of SARS-CoV-2 main protease (MPro) in complex with the covalent inhibitor GUE-3642 (compound 1 in publication)
Descriptor: (phenylmethyl) ~{N}-[(2~{S})-1-[[(2~{S})-1-[[(2~{S})-1-[[iminomethyl-(phenylmethyl)amino]-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl]amino]-3,3-dimethyl-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-butan-2-yl]carbamate, 3C-like proteinase nsp5, CHLORIDE ION, ...
Authors:Strater, N, Claff, T, Sylvester, K, Mueller, C.E, Guetschow, M.
Deposit date:2023-08-28
Release date:2024-07-03
Method:X-RAY DIFFRACTION (1.77 Å)
Cite:Development of an active-site titrant for SARS-CoV-2 main protease as an indispensable tool for evaluating enzyme kinetics.
Acta Pharm Sin B, 14, 2024

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数据于2024-07-10公开中

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