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4D7G

Human FXIa in complex with small molecule inhibitors.

Functional Information from GO Data
ChainGOidnamespacecontents
A0004252molecular_functionserine-type endopeptidase activity
A0006508biological_processproteolysis
Functional Information from PDB Data
site_idAC1
Number of Residues4
DetailsBINDING SITE FOR RESIDUE TRS A 1256
ChainResidue
ASER81
APHE83
AASN113
AGLN118

site_idAC2
Number of Residues2
DetailsBINDING SITE FOR RESIDUE GOL A 1244
ChainResidue
AE6U1250
AHOH2032

site_idAC3
Number of Residues4
DetailsBINDING SITE FOR RESIDUE GOL A 1245
ChainResidue
AE6U1250
ASER214
ATRP215
AGLY216

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL A 1246
ChainResidue
AGLU26
ALYS202
ATRP203
AGOL1247
AGOL1249

site_idAC5
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL A 1247
ChainResidue
AGLU26
AASP135
ATRP137
ATRP203
AGOL1246

site_idAC6
Number of Residues3
DetailsBINDING SITE FOR RESIDUE GOL A 1248
ChainResidue
AHIS38
AGLN74
AE6U1250

site_idAC7
Number of Residues3
DetailsBINDING SITE FOR RESIDUE GOL A 1249
ChainResidue
AGLU26
AARG119
AGOL1246

site_idAC8
Number of Residues21
DetailsBINDING SITE FOR RESIDUE E6U A 1250
ChainResidue
AHIS38
ALEU39
AHIS57
ATYR143
ALYS149
AILE151
AASP189
AALA190
ACYS191
ALYS192
AGLY193
AASP194
ASER195
ASER214
ATRP215
AGLY218
AGOL1244
AGOL1245
AGOL1248
AHOH2026
AHOH2032

site_idAC9
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 1251
ChainResidue
ALYS127
ALYS127
ALYS127
AARG130
AARG130
AARG130

site_idBC1
Number of Residues7
DetailsBINDING SITE FOR RESIDUE SO4 A 1252
ChainResidue
AGLY19
ATHR20
AALA21
AGLN48
AGLN86
AGLU109
AGLN156

site_idBC2
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 A 1253
ChainResidue
ATYR184
AARG185
AGLU186

site_idBC3
Number of Residues6
DetailsBINDING SITE FOR RESIDUE SO4 A 1254
ChainResidue
ALYS127
ALYS127
ALYS127
AARG130
AARG130
AARG130

site_idBC4
Number of Residues3
DetailsBINDING SITE FOR RESIDUE SO4 A 1255
ChainResidue
AASN131
AASN131
AASN131

Functional Information from PROSITE/UniProt
site_idPS00134
Number of Residues6
DetailsTRYPSIN_HIS Serine proteases, trypsin family, histidine active site. LTAAHC
ChainResidueDetails
ALEU53-CYS58

site_idPS00135
Number of Residues12
DetailsTRYPSIN_SER Serine proteases, trypsin family, serine active site. DAckGDSGGPLS
ChainResidueDetails
AASP189-SER198

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues3
DetailsACT_SITE: Charge relay system
ChainResidueDetails
AHIS57
AASP102
ASER195

site_idSWS_FT_FI2
Number of Residues1
DetailsBINDING:
ChainResidueDetails
ALYS170

site_idSWS_FT_FI3
Number of Residues1
DetailsCARBOHYD: N-linked (GlcNAc...) (complex) asparagine => ECO:0000269|PubMed:16335952, ECO:0000269|PubMed:19159218, ECO:0000269|PubMed:25092234
ChainResidueDetails
AASN73

site_idSWS_FT_FI4
Number of Residues1
DetailsCARBOHYD: N-linked (GlcNAc...) (complex) asparagine => ECO:0000269|PubMed:16335952, ECO:0000269|PubMed:19159218, ECO:0000269|PubMed:1998667, ECO:0000269|PubMed:25092234
ChainResidueDetails
AASN113

223532

PDB entries from 2024-08-07

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