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. 2021 Sep 14;27(34):5630–5665. doi: 10.3748/wjg.v27.i34.5630

Table 3.

Curcumina, silibylin, sulfuraphane evaluation by Autodock 4.2

Ligand Binding energy (kcal/mol) kI µmol/L Residue interactions
Curcumine -4.6 428.13 Phe 23, Val 25, Leu 28, Phe 26, Thr 30, Val 26
Silybin -5.73 62.57 Phe 23, Phe 26, Val 29
Sulforaphane -3.75 1.79 Val 29, Phe 26, Val 25, Ala 22, Phe 23, Leu 27