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Drug Addiction pp 343–355Cite as

The Role of Crystallography in Drug Design

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Abstract

Structure and function are intimately related. Nowhere is this more important than the area of bioactive molecules. It has been shown that the enantioselectivity of an enzyme is directly related to its chirality. X-ray crystallography is the only method for determining the “absolute” configuration of a molecule and is the most comprehensive technique available to determine the structure of any molecule at atomic resolution. Results from crystallographic studies provide unambiguous, accurate, and reliable 3-dimensional structural parameters, which are prerequisites for rational drug design and structure-based functional studies.

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Author information

Authors and Affiliations

  1. Laboratory for the Structure of Matter, Naval Research Laboratory, Washington, DC, 20375

    Jeffrey R. Deschamps (Research Chemist)

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  1. Jeffrey R. Deschamps
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Correspondence to Jeffrey R. Deschamps .

Editor information

Editors and Affiliations

  1. National Institute on Drug Abuse, Bethesda, MD, USA

    Rao S. Rapaka

  2. College of Medicine and Public Health, Ohio State University, Columbus, OH, USA

    Wolfgang Sadée

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© 2008 American Association of Pharmaceutical Scientists

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Deschamps, J.R. (2008). The Role of Crystallography in Drug Design. In: Rapaka, R.S., Sadée, W. (eds) Drug Addiction. Springer, New York, NY. https://doi.org/10.1007/978-0-387-76678-2_21

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