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Crystal structure of SARS-CoV-2 3CL protease in complex with compound 4 in space group P1

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Protein Data Bank Japan2024-10-09 更新2026-03-21 收录
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Crystal structure of SARS-CoV-2 3CL protease in complex with compound 4 in space group P1 Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 3C-like proteinase, ethyl (4R)-4-[[(2S)-4-methyl-2-[[(2S,3R)-3-[(2-methylpropan-2-yl)oxy]-2-(phenylmethoxycarbonylamino)butanoyl]amino]pentanoyl]amino]-5-[(3S)-2-oxidanylidenepyrrolidin-3-yl]pentanoate Authors: Iketani, S, Forouhar, F, Liu, H, Hong, S.J, Lin, F.-Y, Nair, M.S, Zask, A, Xing, L, Stockwell, B.R, Chavez, A, Ho, D.D. Deposit date: 2020-08-25 Release date: 2021-03-10 Last modified: 2024-10-09 Method: X-RAY DIFFRACTION (1.84 Å) Cite: Lead compounds for the development of SARS-CoV-2 3CL protease inhibitors. Nat Commun, 12, 2021
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2020-08-25
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