核酸碱基叠加的发现和可视化

H.A. Gabb , S.R. Sanghani , C.H. Robert , C. Prévost
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引用次数: 29

摘要

碱基堆积是稳定核酸结构的主要因素之一。然而,定位DNA和RNA中堆叠相互作用的方法很少,显示堆叠的方法更少。我们在这里提出了简单的自动化程序来搜索核酸分子的碱基和碱基氧堆叠,并以易于传达相互作用的位置和质量的方式图形化地显示这些相互作用。该方法在寻找叠加时,不需要对相对基位进行先验假设,也不依赖于经验能量函数。这是一个明显的优势,原因有二。首先,稳定堆叠基座的力的相对贡献是未知的。其次,现有的势能函数不能很好地定义基层的静电和疏水组分。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
Finding and visualizing nucleic acid base stacking

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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