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Modeled structures of berberine in complex with GH84, GH63, and GH13 enzymes. Electrostatic potential between −6 kT/e and 6 kT/e was shown as a colored gradient from red (acidic) to blue (basic). A, binding mode of berberine in the active pocket of HsOGA. B, binding modes of berberine in the active pocket of ScGluI. C, binding modes of berberine in the active pocket of PPA.
