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DBBP: database of binding pairs in protein-nucleic acid interactions

机译:DBBP:蛋白质-核酸相互作用中的结合对数据库

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Background Interaction of proteins with other molecules plays an important role in many biological activities. As many structures of protein-DNA complexes and protein-RNA complexes have been determined in the past years, several databases have been constructed to provide structure data of the complexes. However, the information on the binding sites between proteins and nucleic acids is not readily available from the structure data since the data consists mostly of the three-dimensional coordinates of the atoms in the complexes. Results We analyzed the huge amount of structure data for the hydrogen bonding interactions between proteins and nucleic acids and developed a database called DBBP ( D ata B ase of B inding P airs in protein-nucleic acid interactions, http://?bclab.?inha.?ac.?kr/?dbbp ). DBBP contains 44,955 hydrogen bonds (H-bonds) of protein-DNA interactions and 77,947 H-bonds of protein-RNA interactions. Conclusions Analysis of the huge amount of structure data of protein-nucleic acid complexes is labor-intensive, yet provides useful information for studying protein-nucleic acid interactions. DBBP provides the detailed information of hydrogen-bonding interactions between proteins and nucleic acids at various levels from the atomic level to the residue level. The binding information can be used as a valuable resource for developing a computational method aiming at predicting new binding sites in proteins or nucleic acids.
机译:背景技术蛋白质与其他分子的相互作用在许多生物学活动中起重要作用。由于在过去几年中已经确定了蛋白质-DNA复合物和蛋白质-RNA复合物的许多结构,因此已经建立了一些数据库来提供复合物的结构数据。但是,由于结构数据主要由复合物中原子的三维坐标组成,因此蛋白质和核酸之间结合位点的信息尚无法从结构数据中获得。结果我们分析了蛋白质和核酸之间氢键相互作用的大量结构数据,并开发了一个名为DBBP(数据库中蛋白质与核酸相互作用的空气中B的D ata B酶)的数据库,网址为:http:// bclab。 inha.?ac.?kr/?dbbp)。 DBBP包含蛋白质-DNA相互作用的44,955个氢键(H键)和蛋白质-RNA相互作用的77,947个H键。结论分析蛋白质-核酸复合物的大量结构数据是费力的,但为研究蛋白质-核酸相互作用提供了有用的信息。 DBBP提供了从原子级到残基级各个级别的蛋白质与核酸之间氢键相互作用的详细信息。结合信息可以用作开发用于预测蛋白质或核酸中新结合位点的计算方法的宝贵资源。

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