Structure of PDB 6r9n Chain B Binding Site BS01

Receptor Information
>6r9n Chain B (length=232) Species: 999430 (Treponema denticola ATCC 35404) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GVVLYEDADHKFIWLGGAVQTMQYLIVDRGRGVLLDPGGLFSRVVTAISR
FISVDKIDTIFFSHQDPDVSSGIALWLGITKAKIYISSLWVRFMPDISRM
VPIPDKGMSISLPSGSNMKCIPSHFMHSPGQFGLYDERSRILFSGDIGAA
VFDDDTTFVEDFEKHLPLIEGFHVRYMASNKIVSKWVEYVRRLNPLMIAP
QHGAIYKDEQVNNFLNWLSGLKCGTDYIENLF
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 chain6r9n Chain B Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6r9n A di-iron protein recruited as an Fe[II] and oxygen sensor for bacterial chemotaxis functions by stabilizing an iron-peroxy species.
Resolution2.074 Å
Binding residue
(original residue number in PDB)
D84 D167 Q224 H225
Binding residue
(residue number reindexed from 1)
D68 D146 Q201 H202
Annotation score4
External links