Brand  (β version)

color scheme of protein:

hetatm:

x
information
centroid:
interaction residue:

chain:

Ligands
Code Name Link
CY6 N-((3s,6r)-6-((S,E)-4-ethoxycarbonyl-1-((S)-2-oxopyrrolidin-3-yl)but-3-en-2-ylcarbamoyl)-2,9-dimethyl-4-oxodec-8-en-3-yl)-5-methylisoxazole-3-carboxamide
Code : 2ALV
Header : HYDROLASE
Title : X-ray structural analysis of SARS coronavirus 3CL proteinase in complex with designed anti-viral inhibitors
Release Data : 2006-08-08
Compound :
mol_id molecule chains synonym
1 Replicase polyprotein 1ab A pp1ab, ORF1AB, Replicase polyprotein 1a
ec: 3.4.22.-
fragment: 3CL proteinase, residues 3242-3543
Source :
mol_id organism_scientific expression_system
1 SARS coronavirus  (taxid:227859) Escherichia coli BL21(DE3)  (taxid:469008)
strain: SARS
expression_system_strain: BL21(DE3)
expression_system_vector_type: PLASMID
expression_system_plasmid: PET11a
Authors : Ghosh, A.K., Xi, K., Ratia, K., Santarsiero, B.D., Fu, W., Harcourt, B.H., Rota, P.A., Baker, S.C., Johnson, M.E., Mesecar, A.D.
Keywords : SARS, coronavirus, 3C, 3Cl, 3CLpro, proteinase, protease, inhibitor, anti-viral, HYDROLASE
Exp. method : X-RAY DIFFRACTION ( 1.90 Å )
Citation :

Design and synthesis of peptidomimetic severe acute respiratory syndrome chymotrypsin-like protease inhibitors.

Ghosh, A.K.,Xi, K.,Ratia, K.  et al.
(2005)  J.Med.Chem.  48 : 6767 - 6771

PubMed: 16250632
DOI: 10.1021/jm050548m

Chain : A
UniProt : P59641 (multiple entry names are found)
Reaction : -