TABLE 2.
Molecular docking binding energy.
Number | Molecular | Protein | PDB id | Binding energey(kcal/Mol) |
---|---|---|---|---|
1 | Stigmasterol | AKT1 | 4ejn | −11.3 |
2 | Corymbosin | AKT1 | 4ejn | −9.9 |
3 | Quercetin | GAPDH | 6iq6 | −9.8 |
4 | beta-sitosterol | AKT1 | 4ejn | −9.5 |
5 | Quercetin | AKT1 | 4ejn | −9.4 |
6 | Kaempferol | AKT1 | 4ejn | −9.3 |
7 | Quercetin | TNF | 2e7a | −9.1 |
8 | beta-sitosterol | TNF | 2e7a | −9.1 |
9 | Quercetin | MAPK3 | 2zoq | −9 |
10 | Kaempferol | GAPDH | 6iq6 | −8.9 |
11 | Corymbosin | GAPDH | 6iq6 | −8.9 |
12 | Kaempferol | TNF | 2e7a | −8.8 |
13 | Kaempferol | MAPK3 | 2zoq | −8.6 |
14 | beta-sitosterol | GAPDH | 6iq6 | −8.5 |
15 | Corymbosin | TNF | 2e7a | −8.5 |
16 | Stigmasterol | GAPDH | 6iq6 | −7.8 |
17 | Stigmasterol | MAPK3 | 2zoq | −7.7 |
18 | beta-sitosterol | MAPK3 | 2zoq | −7.2 |
19 | Stigmasterol | TNF | 2e7a | −7.1 |
20 | Kaempferol | IL6 | 7nxz | −7 |
21 | Stigmasterol | IL6 | 7nxz | −6.9 |
22 | Corymbosin | MAPK3 | 2zoq | −6.9 |
23 | Quercetin | IL6 | 7nxz | −6.8 |
24 | Corymbosin | IL6 | 7nxz | −6.7 |
25 | beta-sitosterol | IL6 | 7nxz | −6.3 |