An exploratory ab initio conformational analysis of selected fragments of nicotinamide adenine dinucleotide (NAD+). Part II: Adenosine

Journal of Molecular Structure: THEOCHEM

Volumn 666-667, Issue , 2003, Pages 431-437

  Lau, Suzanne K ^a,b   Chass, Gregory A ^a,b,c,d   Penke, Botond ^e   Csizmadia, Imre G ^a,b,e  

^a UNIVERSITY OF TORONTO   (Canada)

^b Global Inst Compl Molec Mat Sci   (Canada)

^c Inst Sci d'Ingenierie S   (France)

^d CREIGHTON UNIVERSITY SCHOOL OF MEDICINE   (United States)

^e UNIVERSITY OF SZEGED   (Hungary)

Author keywords

Ab initio; Adenine; Adenosine; Coenzyme; Nicotinamide adenine dinucleotide

Indexed keywords

ADENOSINE; NICOTINAMIDE ADENINE DINUCLEOTIDE;

AB INITIO CALCULATION; ATOM; CHEMICAL ANALYSIS; CHEMICAL STRUCTURE; CONFERENCE PAPER; CONFORMATION; RING OPENING; ROTATION; STRUCTURE ANALYSIS; THEORETICAL MODEL;

EID: 1642492911     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2003.08.118     Document Type: Conference Paper

References (12)

1. Stryer L. Biochemistry. 1988;Freeman, New York. pp. 320-321.
2. Shneyvays V., Mamedora L.K., Leshem D. Exp. Clin. Cardiol. 7:2002;138-145.
3. Acharya P., Chattopadhyaya J. J. Org. Chem. 67:2002;1852.
4. S.K. Lau, G.A. Chass, S. Lovas, B. Penke. Submitted for publication.
5. Ishida T., Tarui M., In Y., Ogiyama M., Doi M., Inoue M. FEBS Lett. 333:1993;214.
6. Shimohigashi Y., Maeda I., Nose T., Ikesue K., Sakamoto H., Ogawa T., Ide Y., Kawahara M., Nezu T., Terada Y., Kawano K., Ohno M. J. Chem. Soc., Perkin Lett. 1. 2479:1996.
7. Smith P.E., Tanner J.J. J. Mol. Recognit. 13:2000;27.
8. M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.A. Montgomery, Jr., R.E. Stratmann, J.C. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudin, M.C. Strain, Ö. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, A.G. Baboul, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, C. Gonzalez, M. Challacombe, P.M.W. Gill, B.G. Johnson, W. Chen, M.W. Wong, J.L. Andres, M. Head-Gordon, E.S. Replogle, J.A. Pople, Gaussian 98 (Revision A.9), Gaussian, Inc., Pittsburgh PA, 1998.
9. Guillot B., Jelsch C., Lecomte C. Acta Cryst. C56:2000;726.
10. Guillot B., Lecomte C., Cousson A., Scherf C., Jelsch C. Acta Cryst. D57:2001;981.
11. Wu Y.-D., Houk K.N. J. Am. Chem. Soc. 113:1991;58.
12. Kahn S.D., Hehre W.J. J. Am. Chem. Soc. 109:1987;666.