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. 2021 Jul 22;12:704074. doi: 10.3389/fphar.2021.704074

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)