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3GJR

Caspase-3 Binds Diverse P4 Residues in Peptides

Functional Information from GO Data
ChainGOidnamespacecontents
A0004197molecular_functioncysteine-type endopeptidase activity
A0006508biological_processproteolysis
A0008234molecular_functioncysteine-type peptidase activity
B0004197molecular_functioncysteine-type endopeptidase activity
B0006508biological_processproteolysis
B0008234molecular_functioncysteine-type peptidase activity
C0004197molecular_functioncysteine-type endopeptidase activity
C0006508biological_processproteolysis
C0008234molecular_functioncysteine-type peptidase activity
D0004197molecular_functioncysteine-type endopeptidase activity
D0006508biological_processproteolysis
D0008234molecular_functioncysteine-type peptidase activity
Functional Information from PDB Data
site_idAC1
Number of Residues10
DetailsBINDING SITE FOR RESIDUE DZE A 1
ChainResidue
AARG64
BARG207
ASER120
AHIS121
AGLY122
AGLN161
ACYS163
BTYR204
BSER205
BTRP206

site_idAC2
Number of Residues10
DetailsBINDING SITE FOR RESIDUE DZE C 2
ChainResidue
CARG64
CSER120
CHIS121
CGLY122
CGLN161
CCYS163
DTYR204
DSER205
DTRP206
DARG207

site_idAC3
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL B 284
ChainResidue
BTRP206
BASN208
BTRP214
BSER249
BPHE250

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL D 284
ChainResidue
DTRP206
DASN208
DTRP214
DSER249
DPHE250

Functional Information from PROSITE/UniProt
site_idPS01121
Number of Residues15
DetailsCASPASE_HIS Caspase family histidine active site. HskrsSfvCvLLSHG
ChainResidueDetails
AHIS108-GLY122

site_idPS01122
Number of Residues12
DetailsCASPASE_CYS Caspase family cysteine active site. KPKLFIIQACRG
ChainResidueDetails
ALYS154-GLY165

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues4
DetailsACT_SITE: ACT_SITE => ECO:0000250|UniProtKB:P29466
ChainResidueDetails
AHIS121
ACYS163
CHIS121
CCYS163

site_idSWS_FT_FI2
Number of Residues2
DetailsMOD_RES: S-nitrosocysteine; in inhibited form => ECO:0000269|PubMed:10213689
ChainResidueDetails
ACYS163
CCYS163

Catalytic Information from CSA
site_idCSA1
Number of Residues3
DetailsAnnotated By Reference To The Literature 1qx3
ChainResidueDetails
AHIS121
AGLY122
ACYS163

site_idCSA2
Number of Residues3
DetailsAnnotated By Reference To The Literature 1qx3
ChainResidueDetails
CHIS121
CGLY122
CCYS163

site_idMCSA1
Number of Residues5
DetailsM-CSA 815
ChainResidueDetails
ATHR62electrostatic stabiliser
ASER63electrostatic stabiliser
AHIS121electrostatic stabiliser, proton acceptor, proton donor
AGLY122electrostatic stabiliser
ACYS163electrostatic stabiliser

site_idMCSA2
Number of Residues5
DetailsM-CSA 815
ChainResidueDetails
CTHR62electrostatic stabiliser
CSER63electrostatic stabiliser
CHIS121electrostatic stabiliser, proton acceptor, proton donor
CGLY122electrostatic stabiliser
CCYS163electrostatic stabiliser

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PDB entries from 2024-08-14

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