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. 2023 Dec 2;17(1):174. doi: 10.1186/s13065-023-01063-5

Table 2.

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

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