Jr. Deschamps et al., TYROSINIUM-D-TETRAHYDROISOQUINOLINE-3-CARBOXYLATE 1.5-HYDRATE AND TYROSYL-D-TETRAHYDROISOQUINOLINE-3-CARBOXAMIDE HYDRATE, Acta crystallographica. Section C, Crystal structure communications, 53, 1997, pp. 1478-1482
Crystals of the two dipeptide title compounds, Tyr-D-Tic, C19H20N2O4.1
.5H(2)O, and Tyr-D-Tic-NH2, C19H21N3O3.H2O, were prepared by the sitti
ng-drop method. Tyr-D-Tic is orthorhombic (P2(1)2(1)2(1)) and crystall
izes as a zwitterion. The asymmetric unit contains two peptide molecul
es and three molecules of water. Tyr-D-Tic-NH2 crystals are monoclinic
(P2(1)), the asymmetric unit containing one peptide molecule and one
molecule of water. Despite some differences in packing, the conformati
on of the two dipeptides is almost identical (r.m.s. deviation for non
-H atoms is approximately 0.18 Angstrom).