Yj. Zheng et Tc. Bruice, IDENTIFYING THE INTERMEDIATE IN THE DIOXYGEN TRANSFER FROM 4A-HYDROPEROXYFLAVIN ANION TO PHENOLATE AND INDOLE ANIONS, Bioorganic chemistry, 25(5-6), 1997, pp. 331-336
Semiempirical and ab initio molecular orbital methods are used to iden
tify the plausible intermediate involved in dioxygen transfer from 4a-
hydroperoxyflavin anion to phenolate and indole anions. According to t
he present study, both 4,4a-dioxetane and 4a,10-dioxetane derived from
4a-hydroperoxyflavin anion are the likely candidates. (C) 1997 Academ
ic Press.