Table 2 The results of in silico docking simulation.
From: Baicalin target protein, Annexin A2, is a target of new antitumor drugs
Model | Auto dock score (kcal/mol) | Etot |
|---|---|---|
Annexin A2 5LQ0 | − 7.6 | |
Annexin A2 2HYW | − 8.8 | − 200,130 kcal/mol (62.36 ns) |
Annexin A2 4HRE | − 8.2 | |
Annexin A2 1XJL | − 8.7 | |
Annexin A2 full length by AlphaFold 2 | − 8.7 | − 232,673 kcal/mol (50.9 ns) |
