Conformational heterogeneity of UCAAUC RNA oligonucleotide from molecular dynamics simulations, SAXS, and NMR experiments

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FIGURE 2.
FIGURE 2.

Agreement between NOE, 3J scalar couplings, unobserved NOE (uNOE), chemical shifts (CS), ambiguous NOE (ambNOE), and SAXS data, as labeled. As a reference, the Formula relative to the ideal A-form structure are 6.13 (NOE), 0.02 (uNOE), and 4.82 (ambNOE), while the values for CS, J3, and SAXS are shown as dashed lines. The two bars show the statistics calculated on two independent runs.

This Article

  1. Published in Advance April 28, 2022, doi: 10.1261/rna.078888.121 RNA 28: 937-946

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