CALCULATED EFFECTS OF THE CHEMICAL ENVIRONMENT OF 2-PHOSPHO-D-GLYCERATE ON THE PK(A) OF ITS CARBON-2 AND CORRELATIONS WITH THE PROPOSED MECHANISM OF ACTION OF ENOLASE
Sh. Hilal et al., CALCULATED EFFECTS OF THE CHEMICAL ENVIRONMENT OF 2-PHOSPHO-D-GLYCERATE ON THE PK(A) OF ITS CARBON-2 AND CORRELATIONS WITH THE PROPOSED MECHANISM OF ACTION OF ENOLASE, Biochemical and biophysical research communications, 211(2), 1995, pp. 607-613
The mechanism of action of enolase requires drastic lowering of the pK
of the a carbon of the substrate to enable removal of the alpha hydro
gen. Calculations suggest this is done primarily by rotation of the ca
rboxyl (''carbon-1'') of the substrate around the carbon-1 carbon-2 bo
nd by 90 degrees so that its oxygen atoms lie in the plane formed by t
he three carbon atoms and secondarily by effectively neutralizing the
negative charges on the carboxylate and phosphate. These predictions a
re in very good agreement with the proposed mechanism of action of eno
lase which is based on X-ray crystallographic data. (C) 1995 Academic
Press, Inc.