Cooperative binding of drugs on human serum albumin |
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Authors: | L M Varela M Pérez-rodríguez M García |
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Institution: | Grupo de Física de Coloides y Polímeros , Departamento de Física de la Materia Condensada, Facultad de Física, Universidad de Santiago de Compostela , E-15782, Santiago de Compostela, Spain |
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Abstract: | In order to explain the adsorption isotherms of the amphiphilic penicillins nafcillin and cloxacillin onto human serum albumin (HSA), a cooperative multilayer adsorption model is introduced, combining the Brunauer–Emmet–Teller (BET) adsorption isotherm with an amphiphilic ionic adsorbate, whose chemical potential is derived from Guggenheim's theory. The non-cooperative model has been previously proved to qualitatively predict the measured adsorption maxima of these drugs Varela, L. M., García, M., Pérez-Rodríguez, M., Taboada, P., Ruso, J. M., and Mosquera, V., 2001, J. chem. Phys., 114, 7682]. The surface interactions among adsorbed drug molecules are modelled in a mean-field fashion, so the chemical potential of the adsorbate is assumed to include a term proportional to the surface coverage, the constant of proportionality being the lateral interaction energy between bound molecules. The interaction energies obtained from the empirical binding isotherms are of the order of tenths of the thermal energy, therefore suggesting the principal role of van der Waals forces in the binding process. |
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Keywords: | hydrogen alloy computer modelling and simulation vacancy electronic structure |
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