Detail Information

P450 Protein:

P450 Symbol
Protein NamePikC D50N–RhFRED
Uniprot ID
SpeciesStreptomyces venezuelae (strain ATCC 10712 / CBS 650.69 / DSM 40230 / JCM 4526 / NBRC 13096 / PD 04745)
Txid 54571
P450 Protein Structure
Model Confidence (pLDDT)
Very high (>90)
High (90 > 70)
Low (70 > 50)
Very low (<50)
Subcellular Location
Protein Sequence GO
RemarksSelf-sufficient PikC D50N variant C-terminally fused to the RhFRED reductase domain.

Reaction Scheme:

Chemical Conversion C20H39NO3 → C20H38NO5
Reaction TypeOxidation
Chemical BondCH2
Conditions3 h, pH 7.3, 30°C

(2S,3R,4S)-2-(cyclododecyloxy)-4-(dimethylamino)-6-methyltetrahydropyran-3-ol

8-{[(2S,3R,4S)-4-(dimethylamino)-3-hydroxy-6-methyl-3,4,5,6-tetrahydro-2H-pyran-2-yl]oxy}cyclododecane-1,3-diol

Substrate Information:

Substrate Name (2S,3R,4S)-2-(cyclododecyloxy)-4-(dimethylamino)-6-methyltetrahydropyran-3-ol
Substrate Chemical FormulaC20H39NO3
Substrate SmilesC1CCCCC(O[C@@H]2OC(C)C[C@H](N(C)C)[C@H]2O)CCCCCC1
Substrate Structure

Product Information:

Product Name 8-{[(2S,3R,4S)-4-(dimethylamino)-3-hydroxy-6-methyl-3,4,5,6-tetrahydro-2H-pyran-2-yl]oxy}cyclododecane-1,3-diol
Product Chemical FormulaC20H38NO5
Product SmilesC(O)1CCCCC(O[C@@H]2OC(C)C[C@H](N(C)C)[C@H]2O)CCCCC(O)C1
Product Structure

References:

Title: Selective oxidation of carbolide C-H bonds by an engineered macrolide P450 mono-oxygenase.
PMID: 19833867
Journal: Proceedings of the National Academy of Sciences of the United States of America (2009)
Year: 2009/10/15

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