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De novo 3D models of SARS-CoV-2 RNA elements from consensus experimental secondary structures

Nucleic Acids Res. 2021-04; 
Ramya Rangan, Andrew M Watkins, Jose Chacon, Rachael Kretsch, Wipapat Kladwang, Ivan N Zheludev, Jill Townley, Mats Rynge, Gregory Thain, Rhiju Das
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Gene Synthesis A DNA library for these constructs was synthesized by Genscript Get A Quote

摘要

The rapid spread of COVID-19 is motivating development of antivirals targeting conserved SARS-CoV-2 molecular machinery. The SARS-CoV-2 genome includes conserved RNA elements that offer potential small-molecule drug targets, but most of their 3D structures have not been experimentally characterized. Here, we provide a compilation of chemical mapping data from our and other labs, secondary structure models, and 3D model ensembles based on Rosetta's FARFAR2 algorithm for SARS-CoV-2 RNA regions including the individual stems SL1-8 in the extended 5' UTR; the reverse complement of the 5' UTR SL1-4; the frameshift stimulating element (FSE); and the extended pseudoknot, hypervariable region, and s2m of the 3' UTR. Fo... More

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