Structure of PDB 7jsd Chain A Binding Site BS02

Receptor Information
>7jsd Chain A (length=254) Species: 1488406 (Streptomyces roseifaciens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VHEIDETLEKFLAENYTPERVQQLADRFQRTGFVKFDSHMRIVPEELITA
VRAEADRLVREHKERRDLVLGTTGGTPRNLSVVKSQDVEQSDLIRAVTRS
EVLLTFLAGITRERIIPEVSDDERYLITHQEFASDTHGWHWDDYSFAFNW
ALRMPPIASGGMVQAVPHTHWDKNAPRINETLCERQIDTYGLVSGDLYLL
RSDTTMHRTVPLTEDGAVRTMLVVSWSAERDLGKVLTGNDRWWENPEAGA
AQPV
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 chain7jsd Chain A Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7jsd Reaction pathway engineering converts a radical hydroxylase into a halogenase.
Resolution2.5 Å
Binding residue
(original residue number in PDB)		H139 H142 D144 Y200 H209 T211 R221 M223 V225
Binding residue
(residue number reindexed from 1)		H137 H140 D142 Y198 H207 T209 R219 M221 V223
Annotation score4
External links