Figure 1
The molecular structures of Z–Gly–Aib–OH showing the 50% probability displacement ellipsoids and simplified atom numbering (Farrugia, 2012). (a) The asymmetric unit of the complex with Ca2+ and H2O (I). One metal ion is coordinated by two symmetry-inverted peptides and water molecules. (b) The structure of the neutral dipeptide Z-Gly-Aib-OH (II). |