7XRS
Crystal structure of SARS-Cov-2 main protease in complex with inhibitor YH-53
Summary for 7XRS
Entry DOI | 10.2210/pdb7xrs/pdb |
Descriptor | Replicase polyprotein 1a, N-[(2S)-1-[[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxidanylidene-3-[(3S)-2-oxidanylidenepyrrolidin-3-yl]propan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]-4-methoxy-1H-indole-2-carboxamide (3 entities in total) |
Functional Keywords | viral protein-inhibitor complex, viral protein/inhibitor |
Biological source | Severe acute respiratory syndrome coronavirus 2 |
Total number of polymer chains | 2 |
Total formula weight | 67449.02 |
Authors | Zhou, X.L.,Zhong, F.L.,Lin, C.,Zeng, P.,Zhang, J.,Li, J. (deposition date: 2022-05-11, release date: 2022-12-21, Last modification date: 2023-11-29) |
Primary citation | Hu, X.,Lin, C.,Xu, Q.,Zhou, X.,Zeng, P.,McCormick, P.J.,Jiang, H.,Li, J.,Zhang, J. Structural Basis for the Inhibition of Coronaviral Main Proteases by a Benzothiazole-Based Inhibitor. Viruses, 14:-, 2022 Cited by PubMed: 36146880DOI: 10.3390/v14092075 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.93 Å) |
Structure validation
Download full validation report