Structure of PDB 1z7j Chain A Binding Site BS01
Receptor Information
>1z7j Chain A (length=116) Species:
9606
(Homo sapiens) [
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CPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGLT
TEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAA
LLSPYSYSTTAVVTNP
Ligand information
Ligand ID
T4A
InChI
InChI=1S/C14H8I4O4/c15-8-4-7(5-9(16)13(8)21)22-14-10(17)1-6(2-11(14)18)3-12(19)20/h1-2,4-5,21H,3H2,(H,19,20)
InChIKey
PPJYSSNKSXAVDB-UHFFFAOYSA-N
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)CC(=O)O
CACTVS 3.341
OC(=O)Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1
ACDLabs 10.04
Ic2cc(Oc1c(I)cc(cc1I)CC(=O)O)cc(I)c2O
Formula
C14 H8 I4 O4
Name
3,3',5,5'-TETRAIODOTHYROACETIC ACID
ChEMBL
CHEMBL549748
DrugBank
DB01751
ZINC
ZINC000008681598
PDB chain
1z7j Chain A Residue 128 [
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Receptor-Ligand Complex Structure
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PDB
1z7j
Ligand binding at the transthyretin dimer-dimer interface: structure of the transthyretin-T4Ac complex at 2.2 Angstrom resolution.
Resolution
2.2 Å
Binding residue
(original residue number in PDB)
K15 A108 A109 L110
Binding residue
(residue number reindexed from 1)
K6 A99 A100 L101
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0005179
hormone activity
GO:0005515
protein binding
GO:0042802
identical protein binding
GO:0070324
thyroid hormone binding
Biological Process
GO:0006144
purine nucleobase metabolic process
GO:0007165
signal transduction
Cellular Component
GO:0005576
extracellular region
GO:0005615
extracellular space
GO:0005737
cytoplasm
GO:0035578
azurophil granule lumen
GO:0070062
extracellular exosome
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Molecular Function
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Biological Process
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Cellular Component
External links
PDB
RCSB:1z7j
,
PDBe:1z7j
,
PDBj:1z7j
PDBsum
1z7j
PubMed
16204882
UniProt
P02766
|TTHY_HUMAN Transthyretin (Gene Name=TTR)
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