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CELL BIOLOGY: Lessons in Rational Drug Design for Protein Kinases
Natalie G. Ahn and Katheryn A. Resing
A Holy Grail of marrying bioinformatics with structural biology is the design of drugs that precisely affect specific cellular targets. Ahn and Resing discuss in their Perspective how combining sequence and structural analysis of the catalytic site of protein kinases allowed one group to rationally design molecules that selectively block p90 ribosomal S6 kinase enzymatic activity in cells.
The authors are in the Department of Chemistry and Biochemistry, University of Colorado, Boulder, CO 80309, USA. E-mail: natalie.ahn{at}colorado.edu
Protein protein interaction inhibition (2P2I) combining high throughput and virtual screening: Application to the HIV-1 Nef protein.
S. Betzi, A. Restouin, S. Opi, S. T. Arold, I. Parrot, F. Guerlesquin, X. Morelli, and Y. Collette (2007)
PNAS
104, 19256-19261
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