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2Z3E

A Mechanistic view of Enzyme Inhibition and Peptide Hydrolysis in the Active Site of the SARS-CoV 3C-Like peptidase

Functional Information from GO Data
ChainGOidnamespacecontents
A0008233molecular_functionpeptidase activity
A0019082biological_processviral protein processing
Functional Information from PDB Data
site_idAC1
Number of Residues8
DetailsBINDING SITE FOR RESIDUE GOL A 801
ChainResidue
ALYS5
ALYS5
AALA7
AVAL125
ATYR126
ATYR126
AGLN127
AGLN127

site_idAC2
Number of Residues3
DetailsBINDING SITE FOR RESIDUE GOL A 802
ChainResidue
AGLY79
AHIS80
AASN63

site_idAC3
Number of Residues17
DetailsBINDING SITE FOR CHAIN I OF ACE VAL Z3E LEU KCQ PEPTIDE
ChainResidue
AHIS41
AMET49
APHE140
AASN142
AGLY143
ASER144
ACYS145
AHIS163
AHIS164
AMET165
AGLU166
APRO168
AHIS172
AGLN189
ATHR190
AHOH865
IHOH1008

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: For 3CL-PRO activity => ECO:0000255|PROSITE-ProRule:PRU00772
ChainResidueDetails
AHIS41
ACYS145

site_idSWS_FT_FI2
Number of Residues1
DetailsSITE: Cleavage; by 3CL-PRO => ECO:0000269|PubMed:14561748
ChainResidueDetails
AGLN306

Catalytic Information from CSA
site_idCSA1
Number of Residues2
DetailsAnnotated By Reference To The Literature 2bx4
ChainResidueDetails
ACYS145
AHIS41

site_idMCSA1
Number of Residues3
DetailsM-CSA 830
ChainResidueDetails
AHIS41proton acceptor, proton donor
AGLY143electrostatic stabiliser
ACYS145electrostatic stabiliser

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PDB entries from 2024-07-24

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