Table 1 Statistics of Eltro docking to BAK (PDB: 2IMS [37]) by HADDOCK.
From: Eltrombopag directly activates BAK and induces apoptosis
Cluster Number | HADDOCK score | Cluster size | RMSDa | Z-Score |
|---|---|---|---|---|
1 | −25.8 ± 1.3 | 230 | 0.8 ± 0.0 | −2.4 |
6 | −22.7 ± 0.9 | 9 | 0.8 ± 0.0 | −0.7 |
5 | −22.4 ± 1.0 | 15 | 0.8 ± 0.0 | −0.6 |
7 | −21.8 ± 2.6 | 9 | 0.9 ± 0.0 | −0.2 |
4 | −21.0 ± 3.6 | 21 | 0.8 ± 0.0 | 0.2 |
2 | −20.6 ± 0.6 | 37 | 0.8 ± 0.0 | 0.4 |
8 | −20.4 ± 2.2 | 9 | 0.8 ± 0.1 | 0.5 |
9 | −20.3 ± 2.7 | 7 | 0.8 ± 0.0 | 0.6 |
3 | −20.0 ± 1.9 | 25 | 0.9 ± 0.1 | 0.8 |
10 | −18.7 ± 0.4 | 5 | 0.8 ± 0.0 | 1.4 |
