6FV2

Structure of human coronavirus NL63 main protease in complex with the alpha-ketoamide (S)-N-benzyl-3-((S)-2-cinnamamido-3-phenylpropanamido)-2-oxo-4-((S)-2-oxopyrrolidin-3-yl)butanamide (cinnamoyl-phenylalanine-GlnLactam-CO-CO-NH-benzyl)

Summary for 6FV2

Entry DOI	10.2210/pdb6fv2/pdb
Descriptor	3C-like proteinase, GLYCEROL, (S)-N-benzyl-3-((S)-2-cinnamamido-3-phenylpropanamido)-2-oxo-4-((S)-2-oxopyrrolidin-3-yl)butanamide, ... (4 entities in total)
Functional Keywords	viral protease, coronavirus, alpha-ketoamide, inhibitor, hydrolase
Biological source	Human coronavirus NL63 (HCoV-NL63)
Total number of polymer chains	3
Total formula weight	101619.97
Authors	Zhang, L.,Hilgenfeld, R. (deposition date: 2018-02-28, release date: 2019-03-20, Last modification date: 2021-04-28)
Primary citation	Zhang, L.,Lin, D.,Kusov, Y.,Nian, Y.,Ma, Q.,Wang, J.,von Brunn, A.,Leyssen, P.,Lanko, K.,Neyts, J.,de Wilde, A.H.,Snijder, E.J.,Liu, H.,Hilgenfeld, R. Alpha-ketoamides as broad-spectrum inhibitors of coronavirus and enterovirus replication Structure-based design, synthesis, and activity assessment. J.Med.Chem., 2020 Cited by PubMed: 32045235 DOI: 10.1021/acs.jmedchem.9b01828 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.95 Å)

Structure validation