Finding and visualizing nucleic acid base stacking |
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Affiliation: | 1. Department of Biochemistry, Duke University, Durham, NC 27710, United States;2. Department of Computer Science, Duke University, Durham, NC 27708, United States;3. Roy J. Carver Department of Biochemistry, Iowa State University, Ames, IA 50011, United States;1. Nanoscience Research Centre (NSRC), Department of Physics, Nirmala College, Muvattupuzha, 686 661, Kerala, India;2. Department of Applied Science and Humanities, Thejus Engineering College, Thrissur, 680584 Kerala, India;3. Microtron Centre, Mangalore University, Mangalagangotri, 574 199 Karnataka, India |
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Abstract: | Base stacking is one of the primary factors stabilizing nucleic acid structure. Yet, methods for locating stacking interactions in DNA and RNA are rare and methods for displaying stacking are rarer still. We present here simple, automated procedures to search nucleic acid molecules for base-base and base-oxygen stacking and to display these interactions graphically in a manner that readily conveys both the location and the quality of the interaction. The method makes no a priori assumptions about relative base positions when searching for stacking, nor does it rely on empirical energy functions. This is a distinct advantage for two reasons. First, the relative contributions of the forces stabilizing stacked bases are unknown. Second, the electrostatic and hydrophobic components of base stacking are both poorly defined by existing potential energy functions. |
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