TABLE 5.
Molecular docking of BSTN1 (11687814) depicting ligand-protein binding interactions.
Ligand | Proteins | Binding energy | Bond length (Å) | Bonding interaction |
---|---|---|---|---|
Bauhiniastatin-1 (BSTN1) | PPAR-γ (3WMH) | –194.0 | 2.3–3 | H-bond interaction [–OH group of tyrosine (Tyr327), JJA—OH group of serine (Ser289), –NH group of histidine (His449)] |
AMPK (6C9F) | –148.62 | 3–3.3 | H-bond interaction (AMP binding site—Thr86, Val127 and Pro129) | |
FAS (6NNA) | –100.0 | 3–3.6 | H-bond interaction (His1263, Asn1458, Arg1461 and Arg1462) |