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. 2026 Feb 19;13:1750178. doi: 10.3389/fnut.2026.1750178

Table 2.

The output results of the best conformations obtained from the molecular docking simulation between both acemannan and punicalagin against BAX (ID: G1SQZ2) and SOD (ID: P41975).

Parameter BAX (G1SQZ2)
Acemannan Punicalagin
Score (Kcal/mol). −10.627 −7.540
RMSD-refined 3.080 4.723
Hydrogen interactions LIG H: GLU248 (O).
LIG O: TYR204 (H).
LIG O: SER 62 (H)
LIG H: ARG 207 (O).
LIG O: TYR250 (H).
LIG H: CYS163 (O).
Parameter SOD (ID: P41975)
Acemannan Punicalagin
Score (Kcal/mol). −10.544 −7.663
RMSD-refined 3.795 2.467
Hydrogen interactions LIG O: SER62 (H). LIG O: ARG207 (H).
(LIG H:HIS 121) (benzene ring).