Detail Information

P450 Protein:

P450 SymbolCYP2E1
Protein NameCytochrome P450 2E1
Uniprot IDQ05421
EC Number1.14.14.1
SpeciesMus musculus (Mouse)
Txid 10090
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 C2H6O + C21H26N7O17P3-4 + O2 + H+ → C2H4O + C21H25N7O17P3-3 + H2O
Reaction TypeOxidation
Chemical BondCH

Ethanol

+

NADPH(4-)

+

O2

+

H+

CYP2E1

Acetaldehyde

+

NADP+

+

H2O

Substrate Information:

Substrate Name Ethanol
Substrate Chemical FormulaC2H6O
Substrate PubChem CID702
Substrate CAS Number64-17-5
Substrate SmilesCCO
Substrate Structure
Substrate Name NADPH(4-)
Substrate Chemical FormulaC21H26N7O17P3-4
Substrate PubChem CID15983949
Substrate SmilesC1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)([O-])OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)([O-])[O-])O)O)O
Substrate Structure
Substrate Name O2
Substrate Chemical FormulaO2
Substrate PubChem CID977
Substrate CAS Number7782-44-7
Substrate SmilesO=O
Substrate Structure
Substrate Name H+
Substrate Chemical FormulaH+
Substrate PubChem CID1038
Substrate CAS Number12408-02-5
Substrate Smiles[H+]
Substrate Structure

Product Information:

Product Name Acetaldehyde
Product Chemical FormulaC2H4O
Product PubChem CID177
Product CAS Number75-07-0
Product SmilesCC=O
Product Structure
Product Name NADP+
Product Chemical FormulaC21H25N7O17P3-3
Product PubChem CID162422398
Product SmilesC1=CC(=C[N+](=C1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)([O-])OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)O)OP(=O)([O-])[O-])O)O)C(=O)N
Product Structure
Product Name H2O
Product Chemical FormulaH2O
Product PubChem CID962
Product CAS Number7732-18-5
Product SmilesO
Product Structure

References:

Title: Diurnal Regulation and Gene-Specific Vulnerability of Oxidative Alcohol-Metabolizing Enzymes to Circadian Disruption
PMID: 41752176
Journal: International journal of molecular sciences
Year: 2026/2/22

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