Faculty of 1000 evaluation for Geometric properties of nucleic acids with potential for autobuilding [dataset]

Martin Egli
2011 F1000 - Post-publication peer review of the biomedical literature   unpublished
Medium-to high-resolution X-ray structures of DNA and RNA molecules were investigated to find geometric properties useful for automated model building in crystallographic electron-density maps. We describe a simple method, starting from a list of electron-density 'blobs', for identifying backbone phosphates and nucleic acid bases based on properties of the local electron-density distribution. This knowledge should be useful for the automated building of nucleic acid models into electron-density
more » ... maps. We show that the distances and angles involving C1 0 and the P atoms, using the pseudo-torsion angles 0 and 0 that describe the . . . P-C1 0 -P-C1 0 . . . chain, provide a promising basis for building the nucleic acid polymer. These quantities show reasonably narrow distributions with asymmetry that should allow the direction of the phosphate backbone to be established.
doi:10.3410/f.7464956.7756054 fatcat:q4wjxtt6dbhr3msusqhdww5ne4