Detail Information

P450 Protein:

P450 SymbolCYP107A1
Protein Name6-deoxyerythronolide B hydroxylase
Uniprot IDQ00441
EC Number1.14.15.35
SpeciesSaccharopolyspora erythraea (strain ATCC 11635 / DSM 40517 / JCM 4748 / NBRC 13426 / NCIMB 8594 / NRRL 2338)
Txid 405948
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 C9H10 + C4H6N2O2 → C13H16O2 + N2
Reaction TypeOxidation
Chemical Bond
Conditions20 μM P450, 5% MeOH,10 mM Na2S2O4,0.1 M KPi, pH 8.0,argon, rt, 16h

Alpha-Methylstyrene

+

Ethyl diazoacetate

CYP107A1

ethyl (1S,2S)-2-methyl-2-phenylcyclopropane-1-carboxylate

+

Nitrogen

Substrate Information:

Substrate Name Alpha-Methylstyrene
Substrate Chemical FormulaC9H10
Substrate PubChem CID7407
Substrate SmilesC1=CC=CC=C1C(C)=C
Substrate Structure
Substrate Name Ethyl diazoacetate
Substrate Chemical FormulaC4H6N2O2
Substrate PubChem CID12192
Substrate CAS Number623-73-4
Substrate Smiles[N-]=[N+]=CC(=O)OCC
Substrate Structure

Product Information:

Product Name ethyl (1S,2S)-2-methyl-2-phenylcyclopropane-1-carboxylate
Product Chemical FormulaC13H16O2
Product Smiles[C@@](C)(C1=CC=CC=C1)1C[C@@H]1C(OCC)=O
Product Structure
Product Name Nitrogen
Product Chemical FormulaN2
Product PubChem CID947
Product CAS Number7727-37-9
Product SmilesN#N
Product Structure

References:

Title: Mutating a Highly Conserved Residue in Diverse Cytochrome P450s Facilitates Diastereoselective Olefin Cyclopropanation
PMID: 26690878
Journal: Chembiochem : a European journal of chemical biology
Year: 2016/3/2

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