2GX4

Crystal structure of SARS coronavirus 3CL protease inhibitor complex

Summary for 2GX4

Entry DOI	10.2210/pdb2gx4/pdb
Related	1Z1I 1Z1J
Descriptor	3C-like proteinase, N-[(BENZYLOXY)CARBONYL]-O-(TERT-BUTYL)-L-THREONYL-3-CYCLOHEXYL-N-[(1S)-2-HYDROXY-1-{[(3S)-2-OXOPYRROLIDIN-3-YL]METHYL}ETHYL]-L-ALANINAMIDE (3 entities in total)
Functional Keywords	sars, 3cl protease, inhibitor complex, hydrolase
Biological source	SARS coronavirus
Total number of polymer chains	1
Total formula weight	34479.40
Authors	Hsu, M.F.,Wang, A.H.-J. (deposition date: 2006-05-08, release date: 2007-05-08, Last modification date: 2020-04-08)
Primary citation	Yang, S.,Chen, S.J.,Hsu, M.F.,Wu, J.D.,Tseng, C.T.,Liu, Y.F.,Chen, H.C.,Kuo, C.W.,Wu, C.S.,Chang, L.W.,Chen, W.C.,Liao, S.Y.,Chang, T.Y.,Hung, H.H.,Shr, H.L.,Liu, C.Y.,Huang, Y.A.,Chang, L.Y.,Hsu, J.C.,Peters, C.J.,Wang, A.H.,Hsu, M.C. Synthesis, crystal structure, structure-activity relationships, and antiviral activity of a potent SARS coronavirus 3CL protease inhibitor. J.Med.Chem., 49:4971-4980, 2006 Cited by PubMed: 16884309 DOI: 10.1021/jm0603926 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.93 Å)

Structure validation