Structure of PDB 9fek Chain H Binding Site BS01

Receptor Information
>9fek Chain H (length=374) Species: 1715989 (Candidatus Nitrospira inopinata) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KRTYQGKVPLHDNYGPEAKYAVEAEALLPTTKFEEEIARGLELGLPGADS
IKDRRIPTFSRGELPHFAGINTFIKAPYVEDVRKCGQYDVAILGAPFDGG
TTYRAGTRFGPQGIRKISALYGTYSFELGVDLRESVSICDVGDIFTIPGN
IEKTFDQVSKGVGHVFASGAFPVVLGGDHSLGFATVRGVAQHLNGKKLGI
LHFDRHVDTQDTDLDERMHTTPWFHATNIPNVPAKNLVQIGIGGWQAPRP
GVKAGRERQTTIMTVTDCVEMGIENAAKQALEVAFDGVDAVWLSFDVDCL
DAAFVPGTGWPEPGGFLPREVLKFLQIIADTKPLAGMEIVECAPPYDAAE
ITSLMATRVICDVLACQVRSGHLG
Ligand information
Ligand IDMN
InChIInChI=1S/Mn/q+2
InChIKeyWAEMQWOKJMHJLA-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Mn+2]
CACTVS 3.341[Mn++]
FormulaMn
NameMANGANESE (II) ION
ChEMBL
DrugBankDB06757
ZINC
PDB chain9fek Chain H Residue 403 [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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PDB9fek Growth of complete ammonia oxidizers on guanidine
Resolution1.58 Å
Binding residue
(original residue number in PDB)
D207 H209 D299 D301 W313
Binding residue
(residue number reindexed from 1)
D204 H206 D296 D298 W310
Annotation score4
External links