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3O1G

Cathepsin K covalently bound to a 2-cyano pyrimidine inhibitor with a benzyl P3 group.

Functional Information from GO Data
ChainGOidnamespacecontents
A0006508biological_processproteolysis
A0008234molecular_functioncysteine-type peptidase activity
Functional Information from PDB Data
site_idAC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 216
ChainResidue
AASN18
AGLY185
AGLU186
AASN187
AHOH302
AHOH364

site_idAC2
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 A 217
ChainResidue
AARG111
ALYS214
AHOH265

site_idAC3
Number of Residues21
DetailsBINDING SITE FOR RESIDUE O75 A 218
ChainResidue
AGLN19
AGLY23
ASER24
ACYS25
ATHR42
AGLU59
AASN60
AASP61
ACYS63
AGLY64
AGLY65
AGLY66
ATYR67
AALA134
ALEU160
AASN161
AHIS162
AALA163
ALEU209
AHOH268
AHOH307

Functional Information from PROSITE/UniProt
site_idPS00139
Number of Residues12
DetailsTHIOL_PROTEASE_CYS Eukaryotic thiol (cysteine) proteases cysteine active site. QGqCGSCWAfSS
ChainResidueDetails
AGLN19-SER30

site_idPS00639
Number of Residues11
DetailsTHIOL_PROTEASE_HIS Eukaryotic thiol (cysteine) proteases histidine active site. LNHAVLAVGYG
ChainResidueDetails
ALEU160-GLY170

site_idPS00640
Number of Residues20
DetailsTHIOL_PROTEASE_ASN Eukaryotic thiol (cysteine) proteases asparagine active site. HWIiKNSWgenWGnkGYIlM
ChainResidueDetails
AHIS177-MET196

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues3
DetailsACT_SITE: ACT_SITE => ECO:0000250
ChainResidueDetails
ACYS25
AHIS162
AASN182

220472

PDB entries from 2024-05-29

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