N-15 CHEMICAL-SHIFT TENSORS IN NUCLEIC-ACID BASES

Citation
Jz. Hu et al., N-15 CHEMICAL-SHIFT TENSORS IN NUCLEIC-ACID BASES, Journal of the American Chemical Society, 120(38), 1998, pp. 9863-9869
Citations number
29
Categorie Soggetti
Chemistry
ISSN journal
00027863
Volume
120
Issue
38
Year of publication
1998
Pages
9863 - 9869
Database
ISI
SICI code
0002-7863(1998)120:38<9863:NCTINB>2.0.ZU;2-F
Abstract
This paper presents measurements of the principal values of the N-15 c hemical shift tensors in adenine, cytosine, guanine, and thymine. The assignment of the solid-state NMR resonances was done using the liquid values in the corresponding nuclesides and the results of quantum mec hanical calculations of the N-15 tensors, The calculations were also u sed to assign the orientation of the principal axes of the tensors and to evaluate the effect of intermolecular interactions on the N-15 che mical shift tensors of the nucleic acid bases. The results indicate th at calculations including intermolecular interactions produce results in better agreement with the experimental values than those in which t hese interactions are neglected.