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Conformational analysis of a ribopentandeolde tetraphosphate in aqueous solution. A two-dimensional NMR study at 500 MHZ1
Author(s) -
Peter P. Lankhorst,
G. Wille,
Jacques H. van Boom,
Conelis Altona,
Comdis A.G. Haasnoot
Publication year - 1983
Publication title -
nucleic acids research
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 9.008
H-Index - 537
eISSN - 1362-4954
pISSN - 0305-1048
DOI - 10.1093/nar/11.9.2839
Subject(s) - conformational isomerism , nuclear overhauser effect , nuclear magnetic resonance spectroscopy , spectroscopy , ring (chemistry) , crystallography , two dimensional nuclear magnetic resonance spectroscopy , proton , stacking , population , stereochemistry , coupling constant , nuclear magnetic resonance , molecule , physics , chemistry , demography , organic chemistry , quantum mechanics , particle physics , sociology
The 30 ribose proton resonances of the pentaribonucleoside tetraphosphate m6(2)AUm6(2)AUm6(2)A have been assigned unequivocally by means of spin-echo-correlated spectroscopy, 2D J-resolved spectroscopy and Nuclear Overhauser difference spectroscopy, carried out at 500 MHz. A detailed comparison of the conformational properties of the title compound with its constituent fragments m6(2)AUm6(2)AU, m6(2)AUm6(2)A, m6(2)AU and the relevant monomers is given. Chemical shift data indicate the existence of a doubly "bulged out" conformer, in which the two interior U-fragments are not involved in regular nearest neighbour stacking interactions. The coupling constants of the ribose-ring are interpreted in terms of the N/S equilibrium, and population distributions along the backbone angles beta and gamma are presented. The combined data suggest a strong similarity between the 5'-terminal triplets in m6(2)AUm6(2)AUm6(2)A, m6(2)AUm6(2)AU and m6(2)AUm6(2)A2.

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