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Theoretical study on many-body effect of interactions between nucleobases in B-DNA
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- Miyamoto Kengo
- Department of Chemistry, Graduate School of Science, Hiroshima University
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- Aida Misako
- Department of Chemistry, Graduate School of Science, Hiroshima University
Bibliographic Information
- Other Title
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- B-DNAの塩基対間相互作用における多体効果についての理論化学的研究
Description
Interactions between nucleobases in DNA-duplex play an important role in biological systems. In particular, the stacking interactions and many-body effects of interactions between nucleobases depend greatly on the base sequences. Guanine (G) changes into 8-oxoguanine (8OG) after the oxidation. 8OG can take either keto or enol forms by keto-enol tautomerization. The hydrogen bonding pattern of 8OG(enol) is different from that of 8OG(keto). In other words, 8OG(enol) can pair with Thymine (T). Thus, 8OG can form 8OG(keto)-C pair and 8OG(enol)-T pair by keto-enol tautomerization. Experimentally, it has been reported that the probability of point mutation from G to A becomes higher when G changes into 8OG. In this study, we construct B-DNA model including not only Watson-Crick base pairs but also 8OG(keto)-C and 8OG(enol)-T pairs. Then, we discuss many-body effects of the interactions between nucleobases in B-DNA and the induction of point mutation from G to A.
Journal
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- Proceedings of the Symposium on Chemoinformatics
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Proceedings of the Symposium on Chemoinformatics 2015 (0), 70-71, 2015
Division of Chemical Information and Computer Sciences The Chemical Society of Japan
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Details 詳細情報について
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- CRID
- 1390001205736950016
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- NII Article ID
- 130005146349
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- Text Lang
- ja
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- Data Source
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- JaLC
- CiNii Articles
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- Abstract License Flag
- Disallowed