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. 2022 Jul 12;13:921337. doi: 10.3389/fphar.2022.921337

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