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Structural basis for ligand recognition in a mushroom lectin: solvent structure as specificity predictor.

Diego F Gauto1, Santiago Di Lella, Darío A Estrin

  • 1Departamento de Química Inorgánica, Analítica, y Química Física, INQUIMAE-CONICET, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Ciudad Universitaria, Pabellón II, C1428EHA Ciudad de Buenos Aires, Argentina, Argentina.

Carbohydrate Research
|April 2, 2011
PubMed
Summary

The Agaricus bisporus lectin (ABL) has two carbohydrate recognition domains (CRDs) that selectively bind different sugars. Molecular dynamics simulations reveal how these CRDs recognize specific monosaccharides, aiding in the design of targeted therapies.

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