STRUCTURAL STUDIES OF L-seryl-L-HISTIDINE DIPEPTIDE BY MEANS OF MOLECULAR MODELING, DFT AND 1H NMR SPECTROSCOPY
Y. Liu, J.-B. Hou, X.-X. Liu, F.-M. Miao, Y.-F. Zhao
Keywords: Ser-His, dipeptide, molecular modeling, DFT, lowest energy structure
Pages: 873-877
Abstract
L-Seryl-L-histidine dipeptide is of scientific interest mainly because of its various biological activities. In this paper, the lowest energy structure of the dipeptide was determined by molecular modeling, and further validated by quantum chemistry calculations and 1H NMR spectroscopy.
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