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Table 3 Molecular docking summary. The docking score of oleanolic acid (OA) is higher than that of its native ligands

From: Functional network analysis of p85 and PI3K as potential gene targets and mechanism of oleanolic acid in overcoming breast cancer resistance to tamoxifen

Native ligand

Oleanolic acid (OA)

PDB ID

Docking score

RMSD (Ã…)

Ligand atom

Amino acid

Binding type

Distance

Docking score

RMSD (Ã…)

Ligand atom

Amino acid

Binding type

Distance

P85 (4L2Y)

  

C

Met772

ArH

3,93

      

− 14.31

0.383

O

Tyr836

ScD

2.00

− 13.52

2.038

O

Val851

BbD

2.12

  

O

Val851

ScD

1.85

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