Structure of PDB 8wb3 Chain A Binding Site BS03

Receptor Information
>8wb3 Chain A (length=172) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TSQVRQNYHQDSEAAINRQINLELYASYVYLSMSYYFDRDDVALKNFAKY
FLHQSHEEREHAEKLMKLQNQRGGRIFLQDIQKPDCDDWESGLNAMECAL
HLEKNVNQSLLELHKLATDKNDPHLCDFIETHYLNEQVKAIKELGDHVTN
LRKMGAPESGLAEYLFDKHTLG
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 chain8wb3 Chain A Residue 205 [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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PDB8wb3 Human H Chain Ferritin with mutant-K86Q 2 Fe(III)/subunit loading
Resolution2.49 Å
Binding residue
(original residue number in PDB)		D131 E134
Binding residue
(residue number reindexed from 1)		D127 E130
Annotation score1
External links
PDB RCSB:8wb3, PDBe:8wb3, PDBj:8wb3
PDBsum8wb3
PubMed
UniProtP02794|FRIH_HUMAN Ferritin heavy chain (Gene Name=FTH1)

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