Structural Exploration and Conformational Transitions in MDM2 upon DHFR Interaction from Homo sapiens: A Computational Outlook for Malignancy via Epigenetic Disruption
Table 4
Analysis for the strength in the interaction of MDM2 protein after interaction with DHFR protein/MDM2-DHFR complex.
Parameters for strength in interaction
Before interaction
After interaction
Free energy of folding (kcal/mol)
−107.23 (MDM2 protein)
−218.7 (protein complex)
DFire (kcal/mol)
−249.79 (MDM2 protein)
−608.59 (protein complex)
Folding rate for MDM2 protein
1.43209/sec
2.08699/sec
Net area for solvent accessibility for MDM2 protein