Article
Molecular modeling of p-chlorophenoxyacetic acid binding to the CLC-0 channel.
Biochemistry - 13 May 2003
Moran Oscar, Traverso Sonia, Elia Laura, Pusch Michael
Abstract excerpt
Molecular simulation techniques were applied to predict the interaction of the CLC-0 Cl(-) channel and the channel-blocking molecule p-chlorophenoxyacetic acid (CPA). A three-dimensional model of the CLC-0 channel was constructed on the basis of the homology with the bacterial Cl(-) channel StCLC, the structure of which has been solved by X-ray crystallography. Docking of the CPA molecule was obtained by using a...
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