Structure of PDB 5j92 Chain A Binding Site BS01

Receptor Information
>5j92 Chain A (length=258) Species: 266265 (Paraburkholderia xenovorans LB400) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MSLNVEAAHPFIAARIHGLDLSKPLSDERIVEIEQASGQYPVLIFPRQYI
DDDQLLAFAAGFGPLQVDRRRMNNLTSRRWHSDASYLPLPARYSFLLSYI
VPAVGGQTQFADMRAAYDKLPDHLRKVVEGLSCHYDIMASRAAAGFYDAS
DEERKALAPCIHELVRTHPISGRKSLYLSSHATHVVGWPEPEGRDLLREL
TEFATQPQFVYSHEWSVRDLVMWDNRALMHRGRPHIPETDVREMHRATTL
DDRTWTRG
Ligand information
Ligand IDFE2
InChIInChI=1S/Fe/q+2
InChIKeyCWYNVVGOOAEACU-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Fe+2]
CACTVS 3.341[Fe++]
FormulaFe
NameFE (II) ION
ChEMBL
DrugBankDB14510
ZINC
PDB chain5j92 Chain A Residue 401 [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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PDB5j92 Crystal structure of a putative alpha-ketoglutarate dependent 2,4-D dioxygenase from Burkholderia xenovorans
Resolution1.95 Å
Binding residue
(original residue number in PDB)		H114 D116 H263
Binding residue
(residue number reindexed from 1)		H81 D83 H230
Annotation score4
Enzymatic activity
Catalytic site (original residue number in PDB) H114 D116 H263 R279
Catalytic site (residue number reindexed from 1) H81 D83 H230 R246
Enzyme Commision number 1.14.11.-
Gene Ontology
Molecular Function
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
GO:0051213 dioxygenase activity

View graph for
Molecular Function
External links
PDB RCSB:5j92, PDBe:5j92, PDBj:5j92
PDBsum5j92
PubMed
UniProtQ13Q05

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