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5WKK

1.55 A resolution structure of MERS 3CL protease in complex with inhibitor GC813

Functional Information from GO Data
ChainGOidnamespacecontents
A0008233molecular_functionpeptidase activity
A0019082biological_processviral protein processing
Functional Information from PDB Data
site_idAC1
Number of Residues6
Detailsbinding site for residue PG4 A 401
ChainResidue
AMET6
ATHR126
AMET298
AHOH514
AHOH516
AHOH541

site_idAC2
Number of Residues6
Detailsbinding site for residue MG A 402
ChainResidue
AHOH607
AHOH652
AHOH722
AHOH540
AHOH548
AHOH597

site_idAC3
Number of Residues18
Detailsbinding site for residue AW4 A 403
ChainResidue
AHIS41
AHIS64
APHE143
AGLY146
ASER147
ACYS148
AHIS166
AGLN167
AMET168
AGLU169
AHIS175
AGLN192
AVAL193
AHIS194
AB3G404
AHOH503
AHOH522
AHOH579

site_idAC4
Number of Residues16
Detailsbinding site for residue B3G A 404
ChainResidue
AHIS41
AHIS64
APHE143
ACYS148
AHIS166
AGLN167
AMET168
AGLU169
AHIS175
AGLN192
AVAL193
AHIS194
AAW4403
AHOH503
AHOH522
AHOH579

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
ACYS148

site_idSWS_FT_FI2
Number of Residues1
DetailsSITE: Cleavage; by 3CL-PRO => ECO:0000250
ChainResidueDetails
AGLN306

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PDB entries from 2024-07-10

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