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4ZG9

Structural basis for inhibition of human autotaxin by four novel compounds

Functional Information from GO Data
ChainGOidnamespacecontents
A0003676molecular_functionnucleic acid binding
A0005044molecular_functionscavenger receptor activity
A0006955biological_processimmune response
A0016787molecular_functionhydrolase activity
A0030247molecular_functionpolysaccharide binding
A0046872molecular_functionmetal ion binding
B0003676molecular_functionnucleic acid binding
B0005044molecular_functionscavenger receptor activity
B0006955biological_processimmune response
B0016787molecular_functionhydrolase activity
B0030247molecular_functionpolysaccharide binding
B0046872molecular_functionmetal ion binding
Functional Information from PROSITE/UniProt
site_idPS00524
Number of Residues21
DetailsSMB_1 Somatomedin B domain (SMB) signature. CrCdnlCksyts.CChDFdelC
ChainResidueDetails
ACYS74-CYS94
ACYS118-CYS138

Functional Information from SwissProt/UniProt
site_idSWS_FT_FI1
Number of Residues2
DetailsACT_SITE: Nucleophile => ECO:0000250|UniProtKB:Q9R1E6
ChainResidueDetails
ATHR210
BTHR210

site_idSWS_FT_FI2
Number of Residues8
DetailsBINDING: BINDING => ECO:0000269|PubMed:26371182, ECO:0000269|PubMed:27754931, ECO:0007744|PDB:4ZG6, ECO:0007744|PDB:4ZG7, ECO:0007744|PDB:4ZG9, ECO:0007744|PDB:5KXA
ChainResidueDetails
AASP172
ATHR210
AASP359
AHIS360
BASP172
BTHR210
BASP359
BHIS360

site_idSWS_FT_FI3
Number of Residues2
DetailsBINDING: BINDING => ECO:0000250|UniProtKB:Q9R1E6
ChainResidueDetails
AASN231
BASN231

site_idSWS_FT_FI4
Number of Residues8
DetailsBINDING: BINDING => ECO:0000269|PubMed:26371182, ECO:0007744|PDB:4ZG6, ECO:0007744|PDB:4ZG7, ECO:0007744|PDB:4ZG9, ECO:0007744|PDB:4ZGA
ChainResidueDetails
AASP312
AHIS316
AHIS475
AASP744
BASP312
BHIS316
BHIS475
BASP744

site_idSWS_FT_FI5
Number of Residues8
DetailsBINDING: BINDING => ECO:0000269|PubMed:26371182, ECO:0000269|PubMed:27754931, ECO:0007744|PDB:4ZG6, ECO:0007744|PDB:4ZG7, ECO:0007744|PDB:4ZG9, ECO:0007744|PDB:4ZGA, ECO:0007744|PDB:5KXA
ChainResidueDetails
AASP740
AASP742
ALEU746
AASP748
BASP740
BASP742
BLEU746
BASP748

site_idSWS_FT_FI6
Number of Residues2
DetailsSITE: Essential for catalytic activity => ECO:0000250|UniProtKB:Q9R1E6
ChainResidueDetails
ALYS853
BLYS853

site_idSWS_FT_FI7
Number of Residues6
DetailsCARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000255
ChainResidueDetails
AASN54
AASN411
AASN807
BASN54
BASN411
BASN807

site_idSWS_FT_FI8
Number of Residues2
DetailsCARBOHYD: N-linked (GlcNAc...) asparagine => ECO:0000269|PubMed:26371182, ECO:0007744|PDB:4ZG6, ECO:0007744|PDB:4ZG7, ECO:0007744|PDB:4ZG9, ECO:0007744|PDB:4ZGA
ChainResidueDetails
AASN525
BASN525

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PDB entries from 2024-11-06

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