Table 2 Table showing the contribution of individual amino acid resides of 6XPS protein for the binding of Violacein and GDP.

From: Gaining molecular insights towards inhibition of foodborne fungi Aspergillus fumigatus by a food colourant violacein via computational approach

Residue name

Violacein dGbind (Kcal/mol)

GDP dGbind (Kcal/mol)

VAL111

− 5.63

− 5.33

ASN114

− 4.5

− 4.59

LYS11

− 6.03

− 0.34

TYR51

− 5.63

− 0.75

ARG104

− 4.43

− 1.6

PHE59

− 8.3

− 6.47