6XB0

Room temperature X-ray crystallography reveals catalytic cysteine in the SARS-CoV-2 3CL Mpro is highly reactive: Insights for enzyme mechanism and drug design

Summary for 6XB0

Entry DOI	10.2210/pdb6xb0/pdb
Descriptor	3C-like proteinase, DIMETHYL SULFOXIDE (3 entities in total)
Functional Keywords	main protease sars-cov-2 3cl mpro, viral protein, hydrolase
Biological source	Severe acute respiratory syndrome coronavirus 2 (2019-nCoV)
Total number of polymer chains	1
Total formula weight	33935.68
Authors	Kneller, D.W.,Kovalevsky, A.,Coates, L. (deposition date: 2020-06-05, release date: 2020-06-17, Last modification date: 2023-10-18)
Primary citation	Kneller, D.W.,Phillips, G.,O'Neill, H.M.,Tan, K.,Joachimiak, A.,Coates, L.,Kovalevsky, A. Room-temperature X-ray crystallography reveals the oxidation and reactivity of cysteine residues in SARS-CoV-2 3CL M pro : insights into enzyme mechanism and drug design. Iucrj, 7:-, 2020 Cited by PubMed: 33063790 DOI: 10.1107/S2052252520012634 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.8 Å)

Structure validation