Structure of PDB 5iqu Chain A Binding Site BS02

Receptor Information
>5iqu Chain A (length=267) Species: 1433842 (Hapalosiphon welwitschii UTEX B 1830) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ALHFLDINATEVKKYPTAIQDIIINRSFDGMIIRGVFPRDTMEQVARCLE
EGNDGGMKSILNKNEEFGTKVAQIYGHAIDYFASSAIFRQACRTMFQGSP
DFEEQVESIFHSLSGLPVEIPTGPEGQTYTPATIRLLLEGREIAVHVDND
AANHLKTLLDLSDQLSYFIPLTVPEAGGELVVYSLEWNPQEASKYAQMQE
YMDDVEFKIKSNQSQSVAYAPGPGDMLLFNGGRYYHRVSEVIGNSPRRTI
GGFLAFSKQRDKIYYWS
Ligand information
Ligand IDAKG
InChIInChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
InChIKeyKPGXRSRHYNQIFN-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=C(O)C(=O)CCC(=O)O
OpenEye OEToolkits 1.7.6C(CC(=O)O)C(=O)C(=O)O
CACTVS 3.385OC(=O)CCC(=O)C(O)=O
FormulaC5 H6 O5
Name2-OXOGLUTARIC ACID
ChEMBLCHEMBL1686
DrugBankDB08845
ZINCZINC000001532519
PDB chain5iqu Chain A Residue 302 [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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PDB5iqu Structural basis for halogenation by iron- and 2-oxo-glutarate-dependent enzyme WelO5.
Resolution2.51 Å
Binding residue
(original residue number in PDB)		R153 H164 S189 F252 H259 R270 T272
Binding residue
(residue number reindexed from 1)		R135 H146 S166 F229 H236 R247 T249
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:5iqu, PDBe:5iqu, PDBj:5iqu
PDBsum5iqu
PubMed27348090
UniProtA0A067YX61

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