Research Article

Mass Spectrometry and Computer Simulation Predict the Interactions of AGPS and HNRNPK in Glioma

Table 7

Interaction energy of residues at the binding interface of the HNRPK-AGPS complex.

ResidueInteraction energy (kcal/mol)VDW interaction energy (kcal/mol)Electrostatic interaction energy (kcal/mol)

AGPS:ASN134-8.51-1.98-6.54
AGPS:ASN139-5.28-2.24-3.05
AGPS:LYS137-18.14-3.48-14.66
AGPS:ALA148-3.69-2.66-1.02
AGPS:SER149-0.78-0.76-0.02
AGPS:PHE559-7.45-3.57-3.88
AGPS:SER589-15.98-3.02-12.87