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QPARSE:搜索长环或多聚体 G-四链体,这些结构可能具有独特性和可成药性。

QPARSE: searching for long-looped or multimeric G-quadruplexes potentially distinctive and druggable.

机构信息

Department of Molecular Medicine, University of Padova, Padova I-35131, Italy.

CRIBI Biotech Centre, University of Padova, Padova I-35131, Italy.

出版信息

Bioinformatics. 2020 Jan 15;36(2):393-399. doi: 10.1093/bioinformatics/btz569.

Abstract

MOTIVATION

G-quadruplexes (G4s) are non-canonical nucleic acid conformations that are widespread in all kingdoms of life and are emerging as important regulators both in RNA and DNA. Recently, two new higher-order architectures have been reported: adjacent interacting G4s and G4s with stable long loops forming stem-loop structures. As there are no specialized tools to identify these conformations, we developed QPARSE.

RESULTS

QPARSE can exhaustively search for degenerate potential quadruplex-forming sequences (PQSs) containing bulges and/or mismatches at genomic level, as well as either multimeric or long-looped PQS (MPQS and LLPQS, respectively). While its assessment versus known reference datasets is comparable with the state-of-the-art, what is more interesting is its performance in the identification of MPQS and LLPQS that present algorithms are not designed to search for. We report a comprehensive analysis of MPQS in human gene promoters and the analysis of LLPQS on three experimentally validated case studies from HIV-1, BCL2 and hTERT.

AVAILABILITY AND IMPLEMENTATION

QPARSE is freely accessible on the web at http://www.medcomp.medicina.unipd.it/qparse/index or downloadable from github as a python 2.7 program https://github.com/B3rse/qparse.

SUPPLEMENTARY INFORMATION

Supplementary data are available at Bioinformatics online.

摘要

动机

G-四链体(G4s)是非经典的核酸构象,广泛存在于所有生命领域,并且作为 RNA 和 DNA 中的重要调节剂而出现。最近,已经报道了两种新的高级结构:相邻相互作用的 G4 和具有稳定长环形成茎环结构的 G4。由于没有专门的工具来识别这些构象,我们开发了 QPARSE。

结果

QPARSE 可以在基因组水平上穷举搜索包含凸起和/或错配的退化潜在四链体形成序列(PQS),以及多聚体或长环 PQS(分别为 MPQS 和 LLPQS)。虽然它与最新技术的评估相当,但更有趣的是它在识别 MPQS 和 LLPQS 方面的性能,而目前的算法并不是专门为搜索这些结构而设计的。我们报告了人类基因启动子中 MPQS 的综合分析,以及 HIV-1、BCL2 和 hTERT 三个实验验证案例研究中 LLPQS 的分析。

可用性和实现

QPARSE 可在 http://www.medcomp.medicina.unipd.it/qparse/index 上在线免费访问,也可从 github 下载作为 python 2.7 程序 https://github.com/B3rse/qparse。

补充信息

补充数据可在 Bioinformatics 在线获得。

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