Kleinkauf Robert, Houwaart Torsten, Backofen Rolf, Mann Martin
Bioinformatics Group, Department of Computer Science, University of Freiburg, Georges-Köhler-Allee 106, Freiburg, 79110, Germany.
Center for Biological Signaling Studies (BIOSS), University of Freiburg, Freiburg, Germany.
BMC Bioinformatics. 2015 Nov 18;16:389. doi: 10.1186/s12859-015-0815-6.
Many functional RNA molecules fold into pseudoknot structures, which are often essential for the formation of an RNA's 3D structure. Currently the design of RNA molecules, which fold into a specific structure (known as RNA inverse folding) within biotechnological applications, is lacking the feature of incorporating pseudoknot structures into the design. Hairpin-(H)- and kissing hairpin-(K)-type pseudoknots cover a wide range of biologically functional pseudoknots and can be represented on a secondary structure level.
The RNA inverse folding program antaRNA, which takes secondary structure, target GC-content and sequence constraints as input, is extended to provide solutions for such H- and K-type pseudoknotted secondary structure constraint. We demonstrate the easy and flexible interchangeability of modules within the antaRNA framework by incorporating pKiss as structure prediction tool capable of predicting the mentioned pseudoknot types. The performance of the approach is demonstrated on a subset of the Pseudobase ++ dataset.
This new service is available via a standalone version and is also part of the Freiburg RNA Tools webservice. Furthermore, antaRNA is available in Galaxy and is part of the RNA-workbench Docker image.
许多功能性RNA分子折叠成假结结构,这对于RNA三维结构的形成通常至关重要。目前,在生物技术应用中能够折叠成特定结构(即RNA反向折叠)的RNA分子设计缺乏将假结结构纳入设计的功能。发夹型(H型)和亲吻发夹型(K型)假结涵盖了广泛的生物功能性假结,并且可以在二级结构水平上表示。
RNA反向折叠程序antaRNA,它将二级结构、目标GC含量和序列约束作为输入,进行了扩展,以提供针对此类H型和K型假结二级结构约束的解决方案。我们通过纳入能够预测上述假结类型的pKiss作为结构预测工具,展示了antaRNA框架内模块易于灵活互换的特性。该方法的性能在Pseudobase ++数据集的一个子集上得到了验证。
这项新服务可通过独立版本获取,也是弗莱堡RNA工具网络服务的一部分。此外,antaRNA可在Galaxy中使用,并且是RNA工作台Docker镜像的一部分。