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. 2021 Oct 20;41(10):1473–1483. [Article in Chinese] doi: 10.12122/j.issn.1673-4254.2021.10.05

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SX主要活性成分与凋亡、焦亡相关蛋白对接结果

Docking results between the main active components of SX and apoptosis- and pyroptosis-related proteins

Ingredient Molecular docking score(kJ/mol)
Bcl-2 Bax Caspase1 Fas FasL IL-1β IL-18 TNF-α
The values in the table represent free binding energy. Molecular Docking Score≤-5 indicates a good binding interaction between the compound and the target. The lower the binding energy, the more stable the docking module is.
Oxychelerythrine -6.7 -7.2 -6.7 -8.5 -7.3 -7.5 -6.8 -8.8
Eleutheroside A -6.6 -7.8 -7.1 -7.7 -7.7 -7.1 -6.9 -8.6
Cajanin -6.4 -7.8 -6.1 -7.4 -6.4 -7.0 -6.7 -7.2
(-)-Catechin gallate -7.3 -7.8 -7.4 -8.2 -6.4 -7.8 -7.3 -8.6