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. 2022 Feb 3;15(2):195. doi: 10.3390/ph15020195

Table 1.

The selected flavonoids and the binding strength score against MEK1 (Autodock Vina docking energy, X-Score binding energy and pKd). The higher the absolute values of the scores, the better the binding.

Rank Flavonoids Docking Affinity (kcal/mol) Binding Energy (Kcal/mol) pKd or log(Kd)
1 129696793 −10.8 −10.25 7.52
2 10813589 −10.6 −10.96 8.03
3 10991656 −10.5 −9.49 6.95
4 10524567 −10.5 −10.83 7.94
5 10575055 −10.4 −10.11 7.41
Native −9.0 −8.95 6.56