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Literature summary for 4.2.3.18 extracted from

  • Siebert, M.R.; Zhang, J.; Addepalli, S.V.; Tantillo, D.J.; Hase, W.L.
    The need for enzymatic steering in abietic acid biosynthesis: gas-phase chemical dynamics simulations of carbocation rearrangements on a bifurcating potential energy surface (2011), J. Am. Chem. Soc., 133, 8335-8343.
    View publication on PubMed

Organism

Organism UniProt Comment Textmining
synthetic construct
-
enzyme-free system
-

Reaction

Reaction Comment Organism Reaction ID
(+)-copalyl diphosphate = abieta-7,13-diene + diphosphate gas-phase and enzyme-free post-transition state direct dynamics simulation gas-phase reveal that abietadiene synthase must intervene in order to produce abietadiene selectively, steering this reaction to avoid the generation of a sevenmembered ring containing product which is formed in the enzyme-free reaction synthetic construct