Mechanistic Investigation of a Non-Heme Iron Enzyme Catalyzed Epoxidation in (-)-4'-Methoxycyclopenin Biosynthesis

J Am Chem Soc. 2016 Aug 24;138(33):10390-3. doi: 10.1021/jacs.6b05400. Epub 2016 Aug 11.

Abstract

Mechanisms have been proposed for α-KG-dependent non-heme iron enzyme catalyzed oxygen atom insertion into an olefinic moiety in various natural products, but they have not been examined in detail. Using a combination of methods including transient kinetics, Mössbauer spectroscopy, and mass spectrometry, we demonstrate that AsqJ-catalyzed (-)-4'-methoxycyclopenin formation uses a high-spin Fe(IV)-oxo intermediate to carry out epoxidation. Furthermore, product analysis on (16)O/(18)O isotope incorporation from the reactions using the native substrate, 4'-methoxydehydrocyclopeptin, and a mechanistic probe, dehydrocyclopeptin, reveals evidence supporting oxo↔hydroxo tautomerism of the Fe(IV)-oxo species in the non-heme iron enzyme catalysis.

Publication types

  • Research Support, N.I.H., Extramural
  • Research Support, Non-U.S. Gov't

MeSH terms

  • Alkenes / chemistry
  • Aspergillus nidulans / enzymology
  • Benzodiazepinones / chemistry
  • Benzodiazepinones / metabolism
  • Biocatalysis*
  • Enzymes / metabolism*
  • Epoxy Compounds / chemistry*
  • Iron*
  • Kinetics
  • Oxygen / chemistry

Substances

  • Alkenes
  • Benzodiazepinones
  • Enzymes
  • Epoxy Compounds
  • cyclopenin
  • Iron
  • Oxygen