Papers

Peer-reviewed
Oct, 2018

Nearest-neighbor parameter for inosine-cytosine pairs through a combined experimental and computational approach

  • Shun Sakuraba
  • ,
  • Junichi Iwakiri
  • ,
  • Michiaki Hamada
  • ,
  • Tomoshi Kameda
  • ,
  • Genichiro Tsuji
  • ,
  • Yasuaki Kimura
  • ,
  • Hiroshi Abe
  • ,
  • Kiyoshi Asai

DOI
10.1101/454124
Publisher
Cold Spring Harbor Laboratory

<title>Abstract</title>In RNA secondary structure prediction, nearest-neighbor parameters are used to determine the stability of a given structure. We derived the nearest-neighbor parameters for RNAs containing inosine-cytosine pairs. For parameter derivation, we developed a method that combines UV adsorption measurement experiments with free-energy calculations using molecular dynamics simulations. The method provides fast drop-in parameters for modified bases. Derived parameters were compared and found to be consistent with existing parameters for canonical RNAs. A duplex with an internal inosine-cytosine pair is 0.9 kcal/mol more unstable than the same duplex with an internal guanine-cytosine pair, and is as stable as the one with an internal adenine-uracil pair (only 0.1 kcal/mol more stable) on average.

Link information
DOI
https://doi.org/10.1101/454124
URL
http://orcid.org/0000-0001-5768-2389
ID information
  • DOI : 10.1101/454124
  • ORCID - Put Code : 49862767

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