In Silico Studies on Development of Novel Virostatic Agents against Bluetongue Virus

Table 2

Dock scores of the ligand compounds into the modeled wild and mutant VP7 protein active site.

S. No.	Ligand	Wild	Hydrogen bonds	Mutant (K255L)	Hydrogen bonds
1	T-l	41.38	1	54.47	5
2	T-2	35.23	2	55.42	4
3	T-3	34.44	2	52.53	7
4	T-4	38.40	3	43.57	3
5	T-7	38.34	3	31.48	3
6	T-8	11.60	1	—	—
7	T-9	11.832	1	—	—
8	T-10	13.20	1	—	—
9	T-l 3	34.23	1	—	—

The stability of the best docked poses of T-1, T-2, and T-3 is evaluated by determining the hydrogen bonding between the receptor and ligand.