Vol. 1, Issue 4, Part A (2014)

Fig. 1: The representation of 3D model of Aedes aegypti UDP N-acetyl glucosamine pyrophosphorylase (AaUAP).

Fig. 2: Schematic representations of 2D images of ligands used in this study

Fig. 3: (A-J) Schematic representations of 2D images of inhibitors used for docking

Fig. 4: Validation results for the modeled protein A) The Ramachandran plot and B) The Verify3D plot

Fig. 5: Representation of sequence alignment of the template (1JV1) and target (AaUAP)

Fig. 6: Binding modes of the complexes of AaUAP with A) NAGP and UTP, B) UDPGalNAc, C) NAG9 and D) The surface representation of the protein AaUAP with NAG9 in the active site

Fig. 7: (A-F) Molecular dynamic simulation results of AaUAP (A, C and E), AaUAP-NAGP-UTP and AaUAP-UDPGalNAc (B, D and F