Ontology highlight
ABSTRACT:
SUBMITTER: Ganser LR
PROVIDER: S-EPMC5942591 | biostudies-literature | 2018 May
REPOSITORIES: biostudies-literature
Ganser Laura R LR Lee Janghyun J Rangadurai Atul A Merriman Dawn K DK Kelly Megan L ML Kansal Aman D AD Sathyamoorthy Bharathwaj B Al-Hashimi Hashim M HM
Nature structural & molecular biology 20180504 5
Dynamic ensembles hold great promise in advancing RNA-targeted drug discovery. Here we subjected the transactivation response element (TAR) RNA from human immunodeficiency virus type-1 to experimental high-throughput screening against ~100,000 drug-like small molecules. Results were augmented with 170 known TAR-binding molecules and used to generate sublibraries optimized for evaluating enrichment when virtually screening a dynamic ensemble of TAR determined by combining NMR spectroscopy data an ...[more]