Fig. 5.

Molecular docking of the α-, β-, γ-mangostin with IP3R (PDB: 3UJ0), KEAP-1 (PDB: 5CGJ), p38 kinase (PDB:2YIS), JNK (PDB:3OY1), nuclear factor kappa-B kinase subunit beta (PDB:4KIK). Here, color of residual indicate the chemical nature where, Asp, Glu: acidic (orange); Leu, Trp, Ala, Val, Ile Met, Cys, Pro, Tyr, Phe: hydrophobic (Green); Lys, Hip, Arg: basic (purple); Gly &water: grey; Thr, Gln, Ser, Asn, Hie, His, Hid: polar (blue) and line between receptor and ligand dictates: pink lines—H-bonds to the protein backbone; Orange line -pi-cation interactions; Green line—pi-pi stacking interactions and colored line near ligand is protein pocket.