INVESTIGADORES
ENRIZ Ricardo Daniel
artículos
Título:
Side-chain conformations for selected backbone conformations of N-acetyl-l-isoleucine-N-methylamide and N-acetyl-l-nor-isoleucine-N-methylamide. An exploratory ab initio study
Autor/es:
M.BARROSO; N. CERUTI; A.M.RODRIGUEZ; E.A.JAUREGUI; O.FARKAS; A.PERCZEL; ENRIZ R.D.
Revista:
JOURNAL OF MOLECULAR STRUCTURE THEOCHEM
Editorial:
ELSEVIER SCIENCE BV
Referencias:
Lugar: Amsterdam; Año: 2001 vol. 548 p. 21 - 37
ISSN:
0166-1280
Resumen:
The Ramachandran or backbone potential energy surface (PES) of N-acetyl-l-isoleucine-N-methylamide has been explored using the a,a side-chain conformation. The side-chain conformational PES were generated with fixed backbone conformations: γl and βl. The βl side-chain PES of the isoleucine derivative was compared to that of the nor-isoleucine derivative