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Analysis of Flexibility and Hotspots in Bcl-xL and Mcl-1 Proteins for the Design of Selective Small-Molecule Inhibitors
[Image: see text] Although Bcl-xL and Mcl-1, two antideath Bcl-2 members, have similar, flexible binding sites, they can achieve high binding selectivity to endogenous binding partners and synthetic small-molecule inhibitors. Here, we employed molecular dynamic (MD) simulations and hotspot analysis...
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| Autori principali: | , |
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| Natura: | Artigo |
| Lingua: | Inglês |
| Pubblicazione: |
American
Chemical Society
2012
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| Accesso online: | https://ncbi.nlm.nih.gov/pmc/articles/PMC4025761/ https://ncbi.nlm.nih.gov/pubmed/24900469 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ml200301w |
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