Crystal structure of SARS-CoV-2 main protease in complex with C2

Crystal structure of SARS-CoV-2 main protease in complex with C2 Descriptor: 3C-like proteinase nsp5, 6-(iminomethyl)-4-(2-pyridin-2-ylethyl)-2-[4-(trifluoromethyl)phenyl]-1,2,4-triazine-3,5-dione Authors: Zeng, R, Deng, X.Y, Yang, Z.Y, Wang, K, Jiang, Y.Y, Lei, J. Deposit date: 2024-02-05 Release date: 2025-02-05 Last modified: 2025-04-23 Method: X-RAY DIFFRACTION (2.5 Å) Cite: A deep learning model for structure-based bioactivity optimization and its application in the bioactivity optimization of a SARS-CoV-2 main protease inhibitor. Eur.J.Med.Chem., 291, 2025