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Structure of PDB 1etb Chain 1 Binding Site BS01

Receptor Information >1etb Chain 1 (length=118) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure] KCPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGL TTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIA TLLSPYSYSTTAVVTNPK

Ligand information Ligand ID T44 InChI InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m0/s1 InChIKey XUIIKFGFIJCVMT-LBPRGKRZSA-N SMILES Software SMILES OpenEye OEToolkits 1.5.0 c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)C[C@@H](C(=O)O)N CACTVS 3.341 N[CH](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O ACDLabs 10.04 O=C(O)C(N)Cc2cc(I)c(Oc1cc(I)c(O)c(I)c1)c(I)c2 CACTVS 3.341 N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O OpenEye OEToolkits 1.5.0 c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)CC(C(=O)O)N Formula C15 H11 I4 N O4 Name 3,5,3',5'-TETRAIODO-L-THYRONINE ChEMBL CHEMBL1624 DrugBank DB00451 ZINC ZINC000003830993 PDB chain 1etb Chain 1 Residue 128 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]

Receptor-Ligand Complex Structure Global view Local view Structure summary [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] [Spin on] [Spin off] [Reset] [High quality] [Low quality] [White background] [Black background] PDB 1etb The x-ray crystal structure refinements of normal human transthyretin and the amyloidogenic Val-30-->Met variant to 1.7-A resolution. Resolution 1.7 Å Binding residue (original residue number in PDB) K15 L17 E54 A108 T109 L110 Binding residue (residue number reindexed from 1) K7 L9 E46 A100 T101 L102 Annotation score 1 Binding affinity BindingDB: IC50=10500nM

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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