Structure of PDB 3bww Chain A Binding Site BS01

Receptor Information
>3bww Chain A (length=253) Species: 205914 (Histophilus somni 129PT) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GMRQGAGLGYRRDLAEGFLQLRNNDRIQFMEIAPENWIKMGGFARYQFDK
VAEKIPILIHGLSLSLGGQAPLDKELLSSIKAMIKQYNTPFFSDHLSFLL
PMPFTDEAVKHTAARIREVQDFLEIQISVENTSYYLHSETSTMNEVEFLN
AIVQEANCGIHLDVNNIYVNAVNHGLLDPHVFIDNVDLKRVNYIHIAGTV
WDLLEYTYARLSHMPPTLLERFPPFEKLCKEVDIIHQLQQKYVKKRGLSW
LKI
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 chain3bww Chain A Residue 307 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3bww Crystal structure of protein of unknown function (DUF692/COG3220) (YP_719350.1) from Haemophilus somnus 129PT at 2.20 A resolution
Resolution2.2 Å
Binding residue
(original residue number in PDB)		H59 H94 E138
Binding residue
(residue number reindexed from 1)		H60 H95 E130
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links