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首页> 外文期刊>The Journal of Chemical Physics >Size,shape,and flexibility of RNA structures
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Size,shape,and flexibility of RNA structures

机译:RNA结构的大小,形状和柔性

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Determination of sizes and flexibilities of RNA molecules is important in understanding the nature of packing in folded structures and in elucidating interactions between RNA and DNA or proteins.Using the coordinates of the structures of RNA in the Protein Data Bank we find that the size of the folded RNA structures,measured using the radius of gyration R_G,follows the Flory scaling law,namely,R_G=5.5N~(1/3) A,where N is the number of nucleotides.The shape of RNA molecules is characterized by the asphericity A and the shape S parameters that are computed using the eigenvalues of the moment of inertia tensor.From the distribution of A,we find that a large fraction of folded RNA structures are aspherical and the distribution of S values shows that RNA molecules are prolate {S>0).The flexibility of folded structures is characterized by the persistence length l_p.By fitting the distance distribution function P(r),that is computed using the coordinates of the folded RNA,to the wormlike chain model we extracted the persistence length l_p.We find that l_p approx= 1.5N~(0.33) A which might reflect the large separation between the free energies that stabilize secondary and tertiary structures.The dependence of l_p on N implies that the average length of helices should increase as the size of RNA grows.We also analyze packing in the structures of ribosomes (30S,50S,and 70S) in terms of R_G,A,S,and l_p.The 70S and the 50S subunits are more spherical compared to most RNA molecules.The globularity in 50S is due to the presence of an unusually large number (compared to 30S subunit) of small helices that are stitched together by bulges and loops.Comparison of the shapes of the intact 70S ribosome and the constituent particles suggests that folding of the individual molecules might occur prior to assembly.
机译:确定RNA分子的大小和柔韧性对于理解折叠结构的堆积性质以及阐明RNA与DNA或蛋白质之间的相互作用非常重要。利用蛋白质数据库中RNA结构的坐标,我们发现RNA分子的大小使用旋转半径R_G测量折叠的RNA结构,遵循弗洛里缩放定律,即R_G = 5.5N〜(1/3)A,其中N是核苷酸数.RNA分子的形状以非球面性为特征A和使用惯性矩张量特征值计算的形状S参数。根据A的分布,我们发现大部分折叠的RNA结构是非球面的,S值的分布表明RNA分子呈长条状{ S> 0)。折叠结构的柔韧性由持久长度l_p表征。通过将距离分布函数P(r)拟合到蠕虫状的柴犬上,该距离分布函数P(r)是使用折叠RNA的坐标计算的在n模型中,我们提取了持久长度l_p,我们发现l_p大约= 1.5N〜(0.33)A,这可能反映了稳定二级结构和三级结构的自由能之间的较大间隔。 RNA的大小会增加螺旋的数量。我们还根据R_G,A,S和l_p分析了核糖体(30S,50S和70S)结构中的堆积。与之相比,70S和50S亚基更呈球形50S的球形性是由于存在大量异常(相对于30S亚基)的小螺旋,这些小螺旋通过凸起和环圈缝合在一起。完整的70S核糖体和组成颗粒的形状比较提示单个分子的折叠可能在组装之前发生。

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