Table 5.
Compound names | IP3R (PDB:3UJ0) |
KEAP-1 (PDB:5CGJ) |
p38 kinase (PDB:2YIS) |
JNK (PDB:3OY1) |
NF-kB (PDB:4KIK) |
||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Docking score | Glide e model | Glide energy | Docking score | Glide e model | Glide energy | Docking score | Glide e model | Glide energy | Docking score | Glide e model | Glide energy | Docking score | Glide e model | Glide energy | |
α -mangostin | −3.357 | −45.267 | −37.929 | −5.63 | −61.434 | −44.618 | −4.569 | −41.359 | −40.702 | −6.707 | −67.529 | −48.892 | −7.187 | −68.143 | −48.554 |
β -mangostin | −3.171 | −44.084 | −37.195 | −4.616 | −55.464 | −43.602 | −4.149 | −49.645 | −41.21 | −6.535 | −67.363 | −50.166 | −6.606 | −68.279 | −51.382 |
γ -mangostin | −3.38 | −45.657 | −38.001 | −4.917 | −56.047 | −43.873 | −5.004 | −45.676 | −38.879 | −6.941 | −71.599 | −50.986 | −7.183 | −72.28 | −51.774 |