Brand  (β version)

PDB ID: 3D62

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Ligands
Code Name Style Show Link
959 Benzyl (2-oxopropyl)carbamate PoSSuM
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Glycosylation
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Structure summary

Code : 3D62   PDBj   RCSB PDB   PDBe
Header : HYDROLASE
Title : Development of Broad-Spectrum Halomethyl Ketone Inhibitors Against Coronavirus Main Protease 3CLpro
Release Data : 2008-07-01
Compound :
mol_id molecule chains synonym
1 3C-like proteinase A 3CL-PRO, 3CLp
ec: 3.4.22.-
fragment: sequence database residues 3243-3541
Source :
mol_id organism_scientific expression_system
1 SARS coronavirus  (taxid:227859) Escherichia coli  (taxid:562)
gene: rep
expression_system_strain: BL21 DE3
Authors : Bacha, U., Barrila, J., Gabelli, S.B., Kiso, Y., Amzel, L.M., Freire, E.
Keywords : main protease 3CLpro, SARS, inhibitor, 95990, ATP-binding, Endonuclease, Exonuclease, Helicase, Hydrolase, Membrane, Metal-binding, Nuclease, Nucleotide-binding, Nucleotidyltransferase, RNA replication, RNA-binding, RNA-directed RNA polymerase, Thiol protease, Transferase, Transmembrane, Zinc-finger
Exp. method : X-RAY DIFFRACTION ( 2.700 Å )
Citation :

Development of broad-spectrum halomethyl ketone inhibitors against coronavirus main protease 3CL(pro).

Bacha, U.,Barrila, J.,Gabelli, S.B.  et al.
(2008)  Chem.Biol.Drug Des.  72 : 34 - 49

PubMed: 18611220
DOI: 10.1111/j.1747-0285.2008.00679.x

Reaction

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