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Joint X-ray/neutron structure of SARS-CoV-2 main protease (3CL Mpro) in complex with Telaprevir

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Protein Data Bank Japan2024-11-13 更新2026-03-21 收录
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Joint X-ray/neutron structure of SARS-CoV-2 main protease (3CL Mpro) in complex with Telaprevir Descriptor: (1S,3aR,6aS)-2-[(2S)-2-({(2S)-2-cyclohexyl-2-[(pyrazin-2-ylcarbonyl)amino]acetyl}amino)-3,3-dimethylbutanoyl]-N-[(2R,3S)-1-(cyclopropylamino)-2-hydroxy-1-oxohexan-3-yl]octahydrocyclopenta[c]pyrrole-1-carboxamide, 3C-like proteinase Authors: Kovalevsky, A.Y, Kneller, D.W, Coates, L. Deposit date: 2021-01-07 Release date: 2021-01-20 Last modified: 2024-11-13 Method: NEUTRON DIFFRACTION (2 Å), X-RAY DIFFRACTION Cite: Direct Observation of Protonation State Modulation in SARS-CoV-2 Main Protease upon Inhibitor Binding with Neutron Crystallography. J.Med.Chem., 64, 2021
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2021-01-07
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