Structure of PDB 6b9t Chain D Binding Site BS02

Receptor Information
>6b9t Chain D (length=453) Species: 436308 (Nitrosopumilus maritimus SCM1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KIDFKPDSYLIRSGNNFLGILNDIKRRPEDAANELGVSIEEINSIISGKQ
KISPSLIEKAVNIWPVNERDFYIVSDDCSSGILIMTSQDSIKSSRIMERA
GKPYYEYRDTAMSKTAPFRPEWILELCKVENNDPENPKAQWNNGHFMHQF
TYFIGEVNFYYKDPEGKKHVAIMNTGDSMYITPFTPHTFTTRDGASQNGL
ILALTYGSKLTGDIQQELSSLSLDCGSQYALDFTNHENASLSLLEYYFEL
SNLTKEKFAKRTNFSMETLADFFTKKKLPTFDELKIIAKALNVNSRDLMP
NDLTESKVIVKTHDQCDHWKYPESGNYEFYELASTTALPHSKAFEIDVSS
SEDLNLDLKVGLHQYVYNIGDSALTINWNYENKTYQKSLNPGDSAYIKPF
VPHNFRGNGKILILRIGGKISGDSQRELSFVGRENTQRAISETMQWFDPK
GSN
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 chain6b9t Chain D Residue 501 [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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PDB6b9t Structural basis for methylphosphonate biosynthesis.
Resolution2.35 Å
Binding residue
(original residue number in PDB)		H148 Q152 H190
Binding residue
(residue number reindexed from 1)		H145 Q149 H187
Annotation score1
Enzymatic activity
Enzyme Commision number 1.13.11.73: methylphosphonate synthase.
Gene Ontology
Molecular Function
GO:0003677 DNA binding
GO:0003700 DNA-binding transcription factor activity
GO:0008198 ferrous iron binding
GO:0016702 oxidoreductase activity, acting on single donors with incorporation of molecular oxygen, incorporation of two atoms of oxygen
GO:0046872 metal ion binding
GO:0051213 dioxygenase activity
Biological Process
GO:0006355 regulation of DNA-templated transcription
GO:0032923 organic phosphonate biosynthetic process

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Molecular Function
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Biological Process
External links
PDB RCSB:6b9t, PDBe:6b9t, PDBj:6b9t
PDBsum6b9t
PubMed29217579
UniProtA9A1T2|MPNS_NITMS Methylphosphonate synthase (Gene Name=mpnS)

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