Cargando…
Computational Insights into Allosteric Conformational Modulation of P-Glycoprotein by Substrate and Inhibitor Binding
The ATP-binding cassette (ABC) transporter P-glycoprotein (P-gp) is a physiologically essential membrane protein that protects many tissues against xenobiotic molecules, but limits the access of chemotherapeutics into tumor cells, thus contributing to multidrug resistance. The atomic-level mechanism...
Autores principales: | Xing, Juan, Huang, Shuheng, Heng, Yu, Mei, Hu, Pan, Xianchao |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2020
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7766389/ https://www.ncbi.nlm.nih.gov/pubmed/33353070 http://dx.doi.org/10.3390/molecules25246006 |
Ejemplares similares
-
Allosteric Role of Substrate Occupancy Toward the Alignment of P-glycoprotein Nucleotide Binding Domains
por: Pan, Lurong, et al.
Publicado: (2018) -
Conformational transitions of caspase-6 in substrate-induced activation process explored by perturbation-response scanning combined with targeted molecular dynamics
por: Huang, Shuheng, et al.
Publicado: (2021) -
Substrate Binding Switches the Conformation at the Lynchpin Site in the Substrate-Binding Domain of Human Hsp70 to Enable Allosteric Interdomain Communication
por: Umehara, Kohei, et al.
Publicado: (2018) -
Computation of Conformational Coupling in Allosteric Proteins
por: Kidd, Brian A., et al.
Publicado: (2009) -
An Energetically Favorable Ligand Entrance Gate of a Multidrug Transporter Revealed by Partial Nudged Elastic Band Simulations
por: Xing, Juan, et al.
Publicado: (2019)