Theoretical Investigation on the Absence of Spore Photoproduct Analogue at Cytosine-Thymine Site
文献类型：期刊论文
| 作者 | Du, Qian; Zhao, Hong-mei; Su, Hong-mei |
| 刊名 | CHINESE JOURNAL OF CHEMICAL PHYSICS
 |
| 出版日期 | 2013-12-01 |
| 卷号 | 26期号:6页码:661-668 |
| 关键词 | Dna Photolesion Cytosine Phosphate Thymine (Cpt) Sp Photoproduct Analogue Density Functional Theory |
| ISSN号 | 1674-0068 |
| DOI | 10.1063/1674-0068/26/06/661-668 |
| 英文摘要 | As a well known DNA photolesion product, the special UV induced pyrimidine dimmer called spore photoproduct (SP), has aroused strong research interests. The SP formation was reported solely between two adjacent thymidine residues. It remains unclear in pervious experimental observations why there is an absence of the cytosine-derived SP-like photoproduct formation at the cytosine containing DNA strand, although the cytosine residue holds great similarity to thymine in terms of molecular structure. From a theoretical perspective, we have explored this issue in this work by means of density functional theory at the B3LYP/6-311++G(d,p)//B3LYP/6-31G(d,p) level for the DNA dinucleotide fragment, cytosine phosphate thymine (CpT). Key factors blocking the formation of the SP-like product between two adjacent cytosine and thymidine residues are revealed. Instead of undergoing photochemical SP reaction, a photophysical deactivation pathway back to the ground state turns out to be favorable for the CpT dinucleotide fragment. |
| 语种 | 英语 |
| WOS记录号 | WOS:000330591600008 |
| 出版者 | CHINESE PHYSICAL SOC |
| 源URL | [http://ir.iccas.ac.cn/handle/121111/54099]  |
| 专题 | 中国科学院化学研究所 |
| 通讯作者 | Su, Hong-mei |
| 作者单位 | Chinese Acad Sci, BNLMS, State Key Lab Mol React Dynam, Inst Chem, Beijing 100190, Peoples R China |
| 推荐引用方式 GB/T 7714 | Du, Qian,Zhao, Hong-mei,Su, Hong-mei. Theoretical Investigation on the Absence of Spore Photoproduct Analogue at Cytosine-Thymine Site[J]. CHINESE JOURNAL OF CHEMICAL PHYSICS,2013,26(6):661-668. |
| APA | Du, Qian,Zhao, Hong-mei,&Su, Hong-mei.(2013).Theoretical Investigation on the Absence of Spore Photoproduct Analogue at Cytosine-Thymine Site.CHINESE JOURNAL OF CHEMICAL PHYSICS,26(6),661-668. |
| MLA | Du, Qian,et al."Theoretical Investigation on the Absence of Spore Photoproduct Analogue at Cytosine-Thymine Site".CHINESE JOURNAL OF CHEMICAL PHYSICS 26.6(2013):661-668. |
入库方式： OAI收割
来源：化学研究所
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