Table 2 Binding energies (kcal/mol) obtained from the docking calculations of NAR with target proteins.

From: Integrating in-silico and experimental validation approaches to unveil the therapeutic mechanism of naringenin against breast cancer

Compound

name

Genes

Binding energy score

H-bonds

Naringenin

SRC

−9.2

Asp404, Lys295, Met341, Leu273

PIK3CA 7R9V

−8.8

Val851, Ser854

BCL2 6GL8

−7.1

Asp111, Ala149, Arg146

ESR1

−8.6

His524, Ala350, Leu387, Leu346

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