Title : Structural and energetic analysis to provide insight residues of CYP2C9, 2C11 and 2E1 involved in valproic acid dehydrogenation selectivity.

Pub. Date : 2014 Jul 15

PMID : 24794636






3 Functional Relationships(s)
Download
Sentence
Compound Name
Protein Name
Organism
1 Structural and energetic analysis to provide insight residues of CYP2C9, 2C11 and 2E1 involved in valproic acid dehydrogenation selectivity. Valproic Acid cytochrome P450 family 2 subfamily C member 9 Homo sapiens
2 In this study, both methods were combined to predict the regioselectivity in the binding mode of valproic acid (VPA) on three cytochrome P-450 (CYP) isoforms CYP2C9, CYP2C11, and CYP2E1, which are involved in the biotransformation of VPA yielding reactive hepatotoxic intermediate 2-n-propyl-4-pentenoic acid (4nVPA). Valproic Acid cytochrome P450 family 2 subfamily C member 9 Homo sapiens
3 In this study, both methods were combined to predict the regioselectivity in the binding mode of valproic acid (VPA) on three cytochrome P-450 (CYP) isoforms CYP2C9, CYP2C11, and CYP2E1, which are involved in the biotransformation of VPA yielding reactive hepatotoxic intermediate 2-n-propyl-4-pentenoic acid (4nVPA). Valproic Acid cytochrome P450 family 2 subfamily C member 9 Homo sapiens