8JPQ

SARS-CoV-2 Mpro in complex with D-5-96

Summary for 8JPQ

• Entry DOI: 10.2210/pdb8jpq/pdb
• Descriptor: ORF1a polyprotein, ACETIC ACID, ALANINE, ... (5 entities in total)
• Functional Keywords: mpro, inhibitor, complex, hydrolase
• Biological source: Severe acute respiratory syndrome coronavirus 2
• Total number of polymer chains: 1
• Total formula weight: 33825.55

Authors

Liu, M.,Huang, H. (deposition date: 2023-06-12, release date: 2023-08-23, Last modification date: 2024-06-12)

• Primary citation: Liu, M.,Li, J.,Liu, W.,Yang, Y.,Zhang, M.,Ye, Y.,Zhu, W.,Zhou, C.,Zhai, H.,Xu, Z.,Zhang, G.,Huang, H.; The S1'-S3' Pocket of the SARS-CoV-2 Main Protease Is Critical for Substrate Selectivity and Can Be Targeted with Covalent Inhibitors.; Angew.Chem.Int.Ed.Engl., 62:e202309657-e202309657, 2023; PubMed: 37609788; DOI: 10.1002/anie.202309657

Experimental method

X-RAY DIFFRACTION (2.7 Å)