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4TY6

Factor XIa in complex with the inhibitor 4-{2-[(1S)-1-({[trans-4-(aminomethyl)cyclohexyl]carbonyl}amino)-2-phenylethyl]-1H-imidazol-4-yl}benzamide

Functional Information from GO Data
ChainGOidnamespacecontents
A0004252molecular_functionserine-type endopeptidase activity
A0006508biological_processproteolysis
Functional Information from PDB Data
site_idAC1
Number of Residues19
Detailsbinding site for residue 39D A 301
ChainResidue
AHIS40
AASP194
ASER195
ATHR213
AGLY218
AEDO303
AHOH484
AHOH539
AHOH618
AHOH621
AHOH622
AHIS57
ATYR143
AILE151
AASP189
AALA190
ACYS191
ALYS192
AGLY193

site_idAC2
Number of Residues4
Detailsbinding site for residue SO4 A 302
ChainResidue
AARG170
AARG170
AARG184
AARG184

site_idAC3
Number of Residues6
Detailsbinding site for residue EDO A 303
ChainResidue
AGLY216
AGLY218
A39D301
AHOH448
AHOH504
AHOH622

site_idAC4
Number of Residues7
Detailsbinding site for residue EDO A 304
ChainResidue
AASN49
ATHR111
AVAL112
AGLY113
ATYR114
AHOH633
AHOH638

site_idAC5
Number of Residues8
Detailsbinding site for residue EDO A 305
ChainResidue
AARG24
ASER99
AGLY173
AHIS174
ALYS175
AHOH414
AHOH429
AHOH458

site_idAC6
Number of Residues9
Detailsbinding site for residue EDO A 306
ChainResidue
AARG24
AGLY25
AGLU26
ATRP27
APRO28
AILE70
ALEU71
AHOH426
AHOH625

site_idAC7
Number of Residues2
Detailsbinding site for residue EDO A 307
ChainResidue
ALYS175
AHIS178

site_idAC8
Number of Residues3
Detailsbinding site for residue EDO A 308
ChainResidue
AHIS34
AILE76
AHOH542

site_idAC9
Number of Residues7
Detailsbinding site for residue EDO A 309
ChainResidue
AGLU167
AARG170
ATYR184
AARG184
AGLU223
APRO225
AHOH507

site_idAD1
Number of Residues4
Detailsbinding site for residue EDO A 310
ChainResidue
AGLU26
ATRP137
ALYS157
AHOH623

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-SER200

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
ALYS169

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
AASN72

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
AGLY113

227111

PDB entries from 2024-11-06

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