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4YM9

Crystal structure of Porcine Pancreatic Elastase (PPE) in complex with the novel inhibitor JM102

Functional Information from GO Data
ChainGOidnamespacecontents
A0004252molecular_functionserine-type endopeptidase activity
A0005515molecular_functionprotein binding
A0005576cellular_componentextracellular region
A0005615cellular_componentextracellular space
A0006508biological_processproteolysis
A0008236molecular_functionserine-type peptidase activity
A0046872molecular_functionmetal ion binding
Functional Information from PDB Data
site_idAC1
Number of Residues13
Detailsbinding site for residue 4E4 A 1001
ChainResidue
AHIS57
APHE215
ASO41004
AHOH1235
AHOH1242
ATHR96
AVAL99
ACYS191
AGLN192
AGLY193
AASP194
ASER195
ASER214

site_idAC2
Number of Residues4
Detailsbinding site for residue SO4 A 1002
ChainResidue
ATYR137
AGLN156
ATYR207
AACT1010

site_idAC3
Number of Residues7
Detailsbinding site for residue SO4 A 1003
ChainResidue
AALA126
ASER232
AALA233
ATYR234
AILE235
ASER236
AHOH1198

site_idAC4
Number of Residues4
Detailsbinding site for residue SO4 A 1004
ChainResidue
APHE215
AVAL216
A4E41001
ASO41005

site_idAC5
Number of Residues4
Detailsbinding site for residue SO4 A 1005
ChainResidue
AGLU62
AVAL99
ATHR174
ASO41004

site_idAC6
Number of Residues7
Detailsbinding site for residue SO4 A 1006
ChainResidue
ATHR146
AGLN192
ASER217
AARG217
AGLY219
ACYS220
AHOH1193

site_idAC7
Number of Residues5
Detailsbinding site for residue ACT A 1007
ChainResidue
AASN76
AASP77
AGLY78
ATYR137
ATYR158

site_idAC8
Number of Residues5
Detailsbinding site for residue ACT A 1008
ChainResidue
AARG36
ATHR64
ASER173
ATHR174
AHOH1106

site_idAC9
Number of Residues3
Detailsbinding site for residue ACT A 1009
ChainResidue
AARG65
ATYR82
AVAL83

site_idAD1
Number of Residues3
Detailsbinding site for residue ACT A 1010
ChainResidue
ASER26
ATYR207
ASO41002

site_idAD2
Number of Residues2
Detailsbinding site for residue ACT A 1011
ChainResidue
AGLN152
ATHR153

site_idAD3
Number of Residues6
Detailsbinding site for residue NA A 1012
ChainResidue
AGLU70
AASN72
AGLN75
AGLU80
AHOH1233
AHOH1246

site_idAD4
Number of Residues5
Detailsbinding site for residue GOL A 1013
ChainResidue
ATRP38
AHIS40
ALEU73
AASN74
AHOH1101

Functional Information from PROSITE/UniProt
site_idPS00134
Number of Residues6
DetailsTRYPSIN_HIS Serine proteases, trypsin family, histidine active site. MTAAHC
ChainResidueDetails
AMET53-CYS58

site_idPS00135
Number of Residues12
DetailsTRYPSIN_SER Serine proteases, trypsin family, serine active site. SGcqGDSGGPLH
ChainResidueDetails
ASER189-HIS200

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues1
DetailsACT_SITE: Charge relay system => ECO:0000269|PubMed:4578945, ECO:0000269|PubMed:5415110
ChainResidueDetails
AHIS57

site_idSWS_FT_FI2
Number of Residues2
DetailsACT_SITE: Charge relay system => ECO:0000269|PubMed:5415110
ChainResidueDetails
AASP102
ASER195

site_idSWS_FT_FI3
Number of Residues4
DetailsBINDING: BINDING => ECO:0000269|PubMed:7656008, ECO:0007744|PDB:1ELA, ECO:0007744|PDB:1ELB, ECO:0007744|PDB:1ELC
ChainResidueDetails
AGLU70
AASN72
AGLN75
AGLU80

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PDB entries from 2024-07-24

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