Structure of PDB 7dt3 Chain A Binding Site BS01

Receptor Information
>7dt3 Chain A (length=114) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
PLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGLTT
EEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAAL
LSPYSYSTTAVVTN
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7dt3 Chain A Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7dt3 Inhibitory activities of anthraquinone and xanthone derivatives against transthyretin amyloidogenesis.
Resolution1.198 Å
Binding residue
(original residue number in PDB)		E66 D99
Binding residue
(residue number reindexed from 1)		E56 D89
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:7dt3, PDBe:7dt3, PDBj:7dt3
PDBsum7dt3
PubMed34225167
UniProtP02766|TTHY_HUMAN Transthyretin (Gene Name=TTR)

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