Structure of PDB 2xr5 Chain A Binding Site BS04

Receptor Information
>2xr5 Chain A (length=131) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
HPCPWEWTFFQGNCYFMSNSQRNWHDSITACKEVGAQLVVIKSAEEQNFL
QLQSSRSNRFTWMGLSDLNQEGTWQWVDGSPLLPSFKQYWNRGEPNNVGE
EDCAEFSGNGWNDDKCNLAKFWICKKSAASC
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 chain2xr5 Chain A Residue 1389 [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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PDB2xr5 Structure of a Glycomimetic Ligand in the Carbohydrate Recognition Domain of C-Type Lectin Dc-Sign. Structural Requirements for Selectivity and Ligand Design.
Resolution1.42 Å
Binding residue
(original residue number in PDB)		E324 E353 D355
Binding residue
(residue number reindexed from 1)		E71 E100 D102
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links
PDB RCSB:2xr5, PDBe:2xr5, PDBj:2xr5
PDBsum2xr5
PubMed23360500
UniProtQ9NNX6|CD209_HUMAN CD209 antigen (Gene Name=CD209)

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