Are adenine strands helical H-aggregates?

被引:24
作者
Hu, LiHong [1 ]
Zhao, Yang [1 ]
Wang, Fan [1 ]
Chen, GuanHua [1 ]
Ma, Chensheng [1 ]
Kwok, Wai-Ming [1 ]
Phillips, David Lee [1 ]
机构
[1] Univ Hong Kong, Ctr Theoret & Computat Phys, Dept Chem, Hong Kong, Peoples R China
关键词
D O I
10.1021/jp070403m
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
On the basis of our quantum mechanical calculation, we propose that homogeneous single-stranded adenine bases (Ade-DNA) form helical H aggregates, and the photoexcited states can be described as Frenkel excitons. The calculated excitonic coupling between adjacent transition dipoles is in good agreement with the measured absorption spectrum of 20-base homogeneous adenine stacks that exhibits a blue shift of 2.6 nm relative to that of the monomeric species.
引用
收藏
页码:11812 / 11816
页数:5
相关论文
共 55 条
[1]   Charge migration in DNA: Ion-gated transport [J].
Barnett, RN ;
Cleveland, CL ;
Joy, A ;
Landman, U ;
Schuster, GB .
SCIENCE, 2001, 294 (5542) :567-571
[2]   Lattice theory of ultrafast excitonic and charge-transfer dynamics in DNA [J].
Bittner, Eric R. .
JOURNAL OF CHEMICAL PHYSICS, 2006, 125 (09)
[3]   Electron interactions between nucleoside pairs in canonical B-DNA: I. Transfer integrals [J].
Brunaud, G ;
Castet, F ;
Fritsch, A ;
Kreissler, M ;
Ducasse, L .
JOURNAL OF PHYSICAL CHEMISTRY B, 2001, 105 (50) :12665-12673
[4]   POLARIZATION OF EXCIMER FLUORESCENCE FROM A DINUCLEOTIDE [J].
CALLIS, PR .
CHEMICAL PHYSICS LETTERS, 1973, 19 (04) :551-555
[5]   Stark spectroscopy of size-selected helical H-aggregates of a cyanine dye templated by duplex DNA. Effect of exciton coupling on electronic polarizabilities [J].
Chowdhury, A ;
Yu, LP ;
Raheem, I ;
Peteanu, L ;
Liu, LA ;
Yaron, DJ .
JOURNAL OF PHYSICAL CHEMISTRY A, 2003, 107 (18) :3351-3362
[6]   Electronic excitations in aggregates of bacteriochlorophylls [J].
Cory, MG ;
Zerner, MC ;
Xu, XC ;
Shulten, K .
JOURNAL OF PHYSICAL CHEMISTRY B, 1998, 102 (39) :7640-7650
[7]   Molecular spectroscopy:: Complexity of excited-state dynamics in DNA -: Reply [J].
Crespo-Hernandez, Carlos E. ;
Cohen, Boiko ;
Kohler, Bern .
NATURE, 2006, 441 (7094) :E8-E8
[8]   Ultrafast excited-state dynamics in nucleic acids [J].
Crespo-Hernández, CE ;
Cohen, B ;
Hare, PM ;
Kohler, B .
CHEMICAL REVIEWS, 2004, 104 (04) :1977-2019
[9]   Base stacking controls excited-state dynamics in A-T DNA [J].
Crespo-Hernández, CE ;
Cohen, B ;
Kohler, B .
NATURE, 2005, 436 (7054) :1141-1144
[10]   Influence of secondary structure on electronic energy relaxation in adenine homopolymers [J].
Crespo-Hernández, CE ;
Kohler, B .
JOURNAL OF PHYSICAL CHEMISTRY B, 2004, 108 (30) :11182-11188