Hitting a Moving Target: Simulation and Crystallography Study of ATAD2 Bromodomain Blockers

[Image: see text] Small molecule ligand binding to the ATAD2 bromodomain is investigated here through the synergistic combination of molecular dynamics and protein crystallography. A previously unexplored conformation of the binding pocket upon rearrangement of the gatekeeper residue Ile1074 has bee...

Fuld beskrivelse

Na minha lista:
Bibliografiske detaljer
Udgivet i:ACS Med Chem Lett
Main Authors: Dolbois, Aymeric, Batiste, Laurent, Wiedmer, Lars, Dong, Jing, Brütsch, Manuela, Huang, Danzhi, Deerain, Nicholas M., Spiliotopoulos, Dimitrios, Cheng-Sánchez, Iván, Laul, Eleen, Nevado, Cristina, Śledź, Paweł, Caflisch, Amedeo
Format: Artigo
Sprog:Inglês
Udgivet: American Chemical Society 2020
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC7429973/
https://ncbi.nlm.nih.gov/pubmed/32832026
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsmedchemlett.0c00080
Tags: Tilføj Tag
Ingen Tags, Vær først til at tagge denne postø!

Lignende værker