Detail Information

P450 Protein:

P450 SymbolCYP101C1
Protein NameCytochrome P450
Uniprot IDQ2G637
SpeciesNovosphingobium aromaticivorans (strain DSM12444)
Txid 279238
P450 Protein Structure
Model Confidence (pLDDT)
Very high (>90)
High (90 > 70)
Low (70 > 50)
Very low (<50)
Subcellular Location
Protein Sequence GO

Reaction Scheme:

Chemical Conversion C12H22O2 → C12H22O3
Reaction TypeOxidation
Chemical BondC=C
TransformationsEpoxidation of Alkenes

3,7-dimethyloct-6-enyl acetate

CYP101C1

[5-(3,3-dimethyloxiran-2-yl)-3-methylpentyl] acetate

Substrate Information:

Substrate Name 3,7-dimethyloct-6-enyl acetate
Substrate Chemical FormulaC12H22O2
Substrate PubChem CID9017
Substrate SmilesCC(CCC=C(C)C)CCOC(=O)C
Substrate Structure

Product Information:

Product Name [5-(3,3-dimethyloxiran-2-yl)-3-methylpentyl] acetate
Product Chemical FormulaC12H22O3
Product PubChem CID11042119
Product CAS Number1787-98-0
Product SmilesCC(CCC1C(O1)(C)C)CCOC(=O)C
Product Structure

References:

Title: Complementary and selective oxidation of hydrocarbon derivatives by two cytochrome P450 enzymes of the same family
DOI: https://doi.org/10.1039/D0CY01040E
Journal: Catalysis Science & Technology
Year: 2020/7/24

Contact zhy1001@alu.uestc.edu.cn or yangzhang@cdutcm.edu.cn
© Department of Bioinformatics