Docking-based approach for identification of mutations that disrupt binding between Bcl-2 and Bax proteins: Inducing apoptosis in cancer cells.
Pawan Kumar RaghavRajesh KumarVinod KumarGajendra P S RaghavaPublished in: Molecular genetics & genomic medicine (2019)
Several methods like PolyPhen-2, SIFT, and OncoKB have been developed to predict cancer-associated or deleterious mutations, but no method is available to predict apoptosis-inducing mutations. Thus, in this study, we have examined the mutations in Bcl-2 and Bax proteins that disrupt their binding, which is crucial for inducing apoptosis to eradicate cancer. This study suggests that protein-protein docking methods can play a significant role in the identification of hotspot mutations in Bcl-2 or Bax that can disrupt their binding with wild-type partner to induce apoptosis in cancer cells.
Keyphrases
- protein protein
- endoplasmic reticulum stress
- oxidative stress
- cell cycle arrest
- induced apoptosis
- cell death
- small molecule
- wild type
- molecular dynamics
- molecular dynamics simulations
- dna binding
- squamous cell carcinoma
- papillary thyroid
- signaling pathway
- human immunodeficiency virus
- men who have sex with men
- lymph node metastasis