Abstract
Using Gibbs Energies of compounds, as well as Gibbs Energy changes and equilibrium constants of biochemical reactions, the contributions of functional groups to the Gibbs Energy (in aqueous solution, temperature 25°C, and pH=7) have been estimated. These contributions allow the estimation of the Gibbs Free Energy and the equilibrium constant of a biochemical reaction, given the structure of the reactants and products.
Similar content being viewed by others
References
Barman, T. E. (1969).Enzyme Handbook, Volume 1, New York: Springer-Verlag.
Barman, T. E. (1969).Enzyme Handbook, Volume 2, New York: Springer-Verlag.
Barman, T. E. (1974).Enzyme Handbook, Supplement 1, New York: Springer-Verlag.
Burton, K. (1957) “Free Energy Data of Biological Interest”.Ergeb. Physiol. Biol. Chem. Exp. Pharmacol. 49, 275–285.
Hinz, H.-J. (1986).Thermodynamic Data for Biochemistry and Biotechnology, New York: Springer-Verlag.
Joback K. G., and Reid, R. C. (1987). “Estimation of Pure Component Properties from Group Contributions.”Chemical Engineering Communications, in print.
Lehninger, A. E. (1975).Biochemistry, 2nd edition, New York: Worth Publishers.
Mavrovouniotis, M. L., Stephanopoulos, G., and Stephanopoulos G. (1987). “An Intelligent System for the Design of Biochemical Pathways.”1987 Annual Meeting, American Institute of Chemical Engineers, New York.
Reid, R. C., Prausnitz, J. M., and Sherwood, T. K. (1977).The Properties of Gases and Liquids, 3rd edition, New York: McGraw-Hill.
Sober, H. A. (1970).Handbook of Biochemistry, 2nd edition, Cleveland: The Chemical Rubber Company.
Thauer, R. K., Jungermann, K., and Decker, K. (1977). “Energy conservation in chemotrophic anaerobic bacteria”.Bacteriological Reviews 41, 148–156.
Wagman, D. D., Evans, W. H., Parker, V. B., Schumm, R. H., Halow, I., Bailey, S. M., Churney, K. L., and Nuttall, R. L. (1982).The NBS Tables of Chemical Thermodynamic Properties, Washington: American Chemical Society and the American Institute of Physics for the National Bureau of Standards.
Author information
Authors and Affiliations
Rights and permissions
About this article
Cite this article
Mavrovouniotis, M.L., Bayol, P., Lam, TK.M. et al. A group contribution method for the estimation of equilibrium constants for biochemical reactions. Biotechnol Tech 2, 23–28 (1988). https://doi.org/10.1007/BF01874203
Issue Date:
DOI: https://doi.org/10.1007/BF01874203