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2VIN

Fragment-Based Discovery of Mexiletine Derivatives as Orally Bioavailable Inhibitors of Urokinase-Type Plasminogen Activator

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 ACT A1245
ChainResidue
AHIS57
AGLY193
ASER195
A5051247
AHOH2345
AHOH2346

site_idAC2
Number of Residues7
DetailsBINDING SITE FOR RESIDUE SO4 A1246
ChainResidue
ALYS179
AHOH2347
AHOH2348
AHOH2349
ALYS61
AHIS100
ATHR177

site_idAC3
Number of Residues11
DetailsBINDING SITE FOR RESIDUE 505 A1247
ChainResidue
AASP189
ASER190
ACYS191
AGLN192
ASER195
AVAL213
ATRP215
AGLY216
AGLY219
ACYS220
AACT1245

Functional Information from PROSITE/UniProt
site_idPS00134
Number of Residues6
DetailsTRYPSIN_HIS Serine proteases, trypsin family, histidine active site. ISATHC
ChainResidueDetails
AILE53-CYS58

site_idPS00135
Number of Residues12
DetailsTRYPSIN_SER Serine proteases, trypsin family, serine active site. DScqGDSGGPLV
ChainResidueDetails
AASP189-VAL200

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
DetailsMOD_RES: Phosphoserine => ECO:0000269|PubMed:9151681
ChainResidueDetails
ASER146

site_idSWS_FT_FI3
Number of Residues1
DetailsCARBOHYD: N-linked (GlcNAc...) asparagine
ChainResidueDetails
AASN145

221051

PDB entries from 2024-06-12

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