Structure of PDB 2wlu Chain A Binding Site BS01

Receptor Information
>2wlu Chain A (length=166) Species: 1314 (Streptococcus pyogenes) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TLVENIYASVTHNSKNEKTKAVLNQAVADLSVAASIVHQVHWYMRGPGFL
YLHPKMDELLDSLNANLDEVSERLITIGGAPYSTLAEFSKHSKLDEAKGT
YDKTVAQHLARLVEVYLYLSSLYQVGLDITDEEGDAGTNDLFTAAKTEAE
KTIWMLQAERGQGPAL
Ligand information
Ligand IDFE
InChIInChI=1S/Fe/q+3
InChIKeyVTLYFUHAOXGGBS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		[Fe+3]
FormulaFe
NameFE (III) ION
ChEMBL
DrugBankDB13949
ZINC
PDB chain2wlu Chain A Residue 1176 [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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PDB2wlu Crystal Structures of Streptococcus Pyogenes Dpr Reveal a Dodecameric Iron-Binding Protein with a Ferroxidase Site.
Resolution1.94 Å
Binding residue
(original residue number in PDB)		D77 E81
Binding residue
(residue number reindexed from 1)		D68 E72
Annotation score5
Enzymatic activity
Enzyme Commision number 1.16.3.1: ferroxidase.
Gene Ontology
Molecular Function
GO:0008199 ferric iron binding
GO:0016722 oxidoreductase activity, acting on metal ions
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:2wlu, PDBe:2wlu, PDBj:2wlu
PDBsum2wlu
PubMed19727858
UniProtQ99YU7

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