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1MQ5

Crystal Structure of 3-chloro-N-[4-chloro-2-[[(4-chlorophenyl)amino]carbonyl]phenyl]-4-[(4-methyl-1-piperazinyl)methyl]-2-thiophenecarboxamide Complexed with Human Factor Xa

Functional Information from GO Data
ChainGOidnamespacecontents
A0004252molecular_functionserine-type endopeptidase activity
A0006508biological_processproteolysis
Functional Information from PDB Data
site_idAC1
Number of Residues6
DetailsBINDING SITE FOR RESIDUE CA A 501
ChainResidue
AASP70
AASN72
AGLN75
AGLU77
AGLU80
AHOH721

site_idAC2
Number of Residues19
DetailsBINDING SITE FOR RESIDUE XLC A 500
ChainResidue
AARG143
AGLU146
APHE174
AASP189
AALA190
AGLN192
AVAL213
ATRP215
AGLY216
AGLU217
AGLY218
ACYS220
AGLY226
AILE227
ATYR228
AHOH669
ALYS96
AGLU97
ATYR99

site_idAC3
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL A 502
ChainResidue
ALEU47
ASER48
AGLU49
APHE114
APRO120
AHOH766
LTYR130

site_idAC4
Number of Residues5
DetailsBINDING SITE FOR RESIDUE GOL A 503
ChainResidue
ALEU123
APRO124
ALEU235
AHOH626
LARG113

site_idAC5
Number of Residues7
DetailsBINDING SITE FOR RESIDUE GOL L 504
ChainResidue
ALYS65
AGLU84
ATRP127
AHOH636
LCYS100
LGLU102
LHOH764

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. DAcqGDSGGPHV
ChainResidueDetails
AASP189-VAL200

site_idPS01186
Number of Residues16
DetailsEGF_2 EGF-like domain signature 2. CsCarGYtladngkaC
ChainResidueDetails
LCYS109-CYS124

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

Catalytic Information from CSA
site_idCSA1
Number of Residues2
DetailsAnnotated By Reference To The Literature 1a0j
ChainResidueDetails
AASP102
AHIS57

site_idCSA2
Number of Residues2
DetailsAnnotated By Reference To The Literature 1a0j
ChainResidueDetails
ASER195
AGLY196

site_idCSA3
Number of Residues2
DetailsAnnotated By Reference To The Literature 1a0j
ChainResidueDetails
ASER195
AGLY193

site_idCSA4
Number of Residues3
DetailsAnnotated By Reference To The Literature 1a0j
ChainResidueDetails
AASP102
ASER195
AHIS57

site_idCSA5
Number of Residues4
DetailsAnnotated By Reference To The Literature 1a0j
ChainResidueDetails
ASER195
AASP100
AGLY193
AHIS57

site_idCSA6
Number of Residues4
DetailsAnnotated By Reference To The Literature 1a0j
ChainResidueDetails
AASP102
ASER195
AHIS57
AGLY196

site_idCSA7
Number of Residues4
DetailsAnnotated By Reference To The Literature 1a0j
ChainResidueDetails
AASP102
ASER195
AGLY193
AHIS57

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PDB entries from 2024-07-24

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