Structure of PDB 7xqw Chain B Binding Site BS03

Receptor Information
>7xqw Chain B (length=541) Species: 272630 (Methylorubrum extorquens AM1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AVPKGRQVDPHAKVEIEELLGTRPRQRDLLIEHLHLIQDTYGQISADHLA
ALADEMSLAFAEVFETATFYAHFDVVKEGEADIPRLTIRVCDSITCAMFG
ADELLETLQRELASDAVRVVRAPCVGLCDHAPAVEVGHNFLHRADLASVR
AAVEAEDTHAHIPTYVDYDAYRAGGGYATLERLRSGELPVDDVLKVLDDG
GLRGLGGAGFPTGRKWRSVRGEPGPRLMAVNGDEGEPGTFKDQLYLNTDP
HRFLEGMLIGAHVVEAADVYIYLRDEYPISREILAREIAKLPEGGTRIHL
RRGAGAYICGEESSLIESLEGKRGLPRHKPPFPFQVGLFNRPTLINNIET
LFWVRDLIERGAEWWKSHGRNGRVGLRSYSVSGRVKEPGVKLAPAGLTIQ
ELIDEYCGGISDGHSFAAYLPGGASGGILPASMNDIPLDFGTLEKYGCFI
GSAAVVILSDQDDVRGAALNLMKFFEDESCGQCTPCRSGTQKARMLMENG
VWDTDLLGELAQCMRDASICGLGQAASNPVSTVIKYFPDLF
Ligand information
Ligand IDFES
InChIInChI=1S/2Fe.2S
InChIKeyNIXDOXVAJZFRNF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04[Fe]1S[Fe]S1
CACTVS 3.341
OpenEye OEToolkits 1.5.0		S1[Fe]S[Fe]1
FormulaFe2 S2
NameFE2/S2 (INORGANIC) CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain7xqw Chain B Residue 603 [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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PDB7xqw Enzymatic conversion of CO2 in real flue gas to molar-scale formate
Resolution2.83 Å
Binding residue
(original residue number in PDB)		C113 S115 C118 C146 V147 L149 C150
Binding residue
(residue number reindexed from 1)		C91 S93 C96 C124 V125 L127 C128
Annotation score1
Enzymatic activity
Enzyme Commision number 1.2.1.2: Transferred entry: 1.17.1.9.
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0008137 NADH dehydrogenase (ubiquinone) activity
GO:0010181 FMN binding
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
GO:0051537 2 iron, 2 sulfur cluster binding
GO:0051539 4 iron, 4 sulfur cluster binding
Biological Process
GO:1902600 proton transmembrane transport

View graph for
Molecular Function
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Biological Process
External links
PDB RCSB:7xqw, PDBe:7xqw, PDBj:7xqw
PDBsum7xqw
PubMed
UniProtC5ATT6

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