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Fig. 3 | BMC Chemistry

Fig. 3

From: Molecular docking, chemo-informatic properties, alpha-amylase, and lipase inhibition studies of benzodioxol derivatives

Fig. 3

A Docking Solution of the compound 3a (left) and 4f (right) inside the binding pocket of alpha-amylase (pdb code: 4w93) forming hydrogen bonds with the residues I235 and E233; while making and charge-π interactions with H201. Other residue like Y151 is also able to make hydrogen bonds or hydrophobic interactions. B The interaction map of the compound 3a (left) and 4f (right) inside the binding pocket of human pancreatic alpha-amylase (pdb code: 4w93) forming hydrogen bonds with the residue I235; while making and charge-π interactions with H201, and other possible HB and hydrophobic interactions with the surrounding residues

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