Structure of PDB 3bxv Chain A Binding Site BS01

Receptor Information
>3bxv Chain A (length=308) Species: 146920 (Acidianus tengchongensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MPKPYIAINMADLKNEPKTFEMFSAVGPKVCMVTARHPGFVGFQNHVQIG
VLPFGERFGGAKMDMTKESSTVRVLQYTMWKDWKDHEEMHRQNWSYLFRL
CYSCASQMVWGPWEPIYEIKYADMPINTEMTDFTAVVGKKFAEGKPLEIP
VISQPYGKRVVAFGEHTVIPGKEEQFEDAIIKTLEMFKRAPGFLGAMLLK
EIGVSGIGSFQFGSKGFHQLLESPGSLEPDPNNVMYQAPEAKPTPPQYIV
HVEWANLDALQFGMGRVLLSPEYREVHDEALDTLIYGPYIRIINPVMEGT
FWREYLNE
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 chain3bxv Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3bxv Crystal structure studies on sulfur oxygenase reductase from Acidianus tengchongensis
Resolution2.7 Å
Binding residue
(original residue number in PDB)		H86 H90 E114
Binding residue
(residue number reindexed from 1)		H86 H90 E114
Annotation score1
Enzymatic activity
Enzyme Commision number 1.13.11.55: sulfur oxygenase/reductase.
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:3bxv, PDBe:3bxv, PDBj:3bxv
PDBsum3bxv
PubMed18329378
UniProtQ977W3

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