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ThreaDNA: predicting DNA mechanics’ contribution to sequence selectivity of proteins along whole genomes
Author(s) -
Jasmin Cevost,
Cédric Vaillant,
Sam Meyer
Publication year - 2017
Publication title -
bioinformatics
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 3.599
H-Index - 390
eISSN - 1367-4811
pISSN - 1367-4803
DOI - 10.1093/bioinformatics/btx634
Subject(s) - executable , computer science , software , python (programming language) , genome , computational biology , dna , graphical user interface , computational science , algorithm , data mining , biology , genetics , programming language , gene
Many DNA-binding proteins recognize their target sequences indirectly, by sensing DNA's response to mechanical distortion. ThreaDNA estimates this response based on high-resolution structures of the protein-DNA complex of interest. Implementing an efficient nanoscale modeling of DNA deformations involving essentially no adjustable parameters, it returns the profile of deformation energy along whole genomes, at base-pair resolution, within minutes on usual laptop/desktop computers. Our predictions can also be easily combined with estimations of direct selectivity through a generalized form of position-weight-matrices. The formalism of ThreaDNA is accessible to a wide audience.

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