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Table 2 Binding score and interactions of C2-ligand into the active cavity of β-tubulin protein

From: Novel 8-Methoxycoumarin-3-Carboxamides with potent anticancer activity against liver cancer via targeting caspase-3/7 and β-tubulin polymerization

Binding score (kcal/mol)

Hydrophobic interactions

Hydrophilic interactions (Hydrogen bonding)

Distance (A)

−12.46

 

ASN167

2.95

CYS241

3.47

Q4ED504

3.68

Q4ED504

3.58

LEU255

 

3.7, 3.75

ALA 316

3.78, 3.77, 4.35

ALA354

3.8

TYR202

5.58