Structure of PDB 5aih Chain B Binding Site BS01

Receptor Information
>5aih Chain B (length=125) Species: 32644 (unidentified) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MTPLETVQLFLARVNALDLDGACALLAEDVVYDNVPMPTVHGRAAARAFL
SQLPATAIDWETHAIAATGDAARGTVLTERTDRFTLADGRTLAIRVMGAF
DVADGSITAWRDYFDLGQFMAQMAP
Ligand information
Ligand IDEDO
InChIInChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChIKeyLYCAIKOWRPUZTN-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OCCO
OpenEye OEToolkits 1.5.0C(CO)O
FormulaC2 H6 O2
Name1,2-ETHANEDIOL;
ETHYLENE GLYCOL
ChEMBLCHEMBL457299
DrugBank
ZINCZINC000005224354
PDB chain5aih Chain B Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5aih Discovery and Characterization of Thermophilic Limonene-1,2-Epoxide Hydrolases from Hot Spring Metagenomic Libraries
Resolution1.42 Å
Binding residue
(original residue number in PDB)
D59 E61
Binding residue
(residue number reindexed from 1)
D59 E61
Annotation score1
External links