Table 4.
Binding interactions of the hit compounds and reference drug with AKT 2
S/N | Compound name | Interacting residues | Conventional H-bond |
---|---|---|---|
1 | Cynaroside | Phe163, Asn230, Glu236, Asp293, and Phe443 | Glu236, and Asn230 |
2 | Epicatechin gallate | Leu158, Phe163, Val166, Glu236, Lys277, and Met282 | – |
3 | Capivasertib (reference drug) | Leu158, Phe163, Val166, Glu279, Asp293, and Phe443 | Leu158 |