PMID:11784161
Dmitrenko, O, Wood, HB, Bach, RD and Ganem, B (2001) A theoretical study of the chorismate synthase reaction.Org. Lett. 3:4137-40
| Abstract | Density functional calculations (B3LYP/6-31+G(d,p)) were carried out to investigate the mechanism of the anti-1,4-elimination of phosphate from 5-enolpyruvylshikimate-3-phosphate 1 that is catalyzed by chorismate synthase. Of particular interest was the functional role of the reduced flavin cofactor. [reaction: see text] |
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