Table 3 Top 10 conformations with minimal binding energy of acacetin to complex II
From: Acacetin alleviates autoimmune myocarditis by regulating CD4+ T cell mitochondrial respiration
Number | Binding energy | RMSD |
|---|---|---|
1 | − 9.2 | 0 |
2 | − 9.1 | 2.392 |
3 | − 9 | 1.369 |
4 | − 7.9 | 46.628 |
5 | − 7.7 | 55.389 |
6 | − 7.7 | 71.515 |
7 | − 7.5 | 24.543 |
8 | − 7.5 | 32.246 |
9 | − 7.4 | 24.453 |