TY - CHAP U1 - Konferenzveröffentlichung A1 - Erichson, Felix A1 - Steffen, Fabio D. A1 - Börner, Richard T1 - FRET-assisted structural model of the GAAA RNA tetraloop receptor T2 - 26. Interdisziplinäre Wissenschaftliche Konferenz Mittweida N2 - Long-range tertiary interactions between RNA tetraloops and their receptors stabilize the folding of ribosomal RNA and support the maturation of the ribosome. Here, we use FRET-assisted structure prediction to develop a structural model of the GAAA tetraloop receptor (TLR) interaction and its dynamics. We build the docked TLR de novo, label the RNA in silico and compute FRET histograms based on MD simulations. The predicted mean FRET efficiency is remarkably consistent with single-molecule experiments of the docked tetraloop. This hybrid approach of experiment and simulation will promote the elucidation of dynamic RNA tertiary contacts and accelerate the discovery of novel RNA and RNA-protein interactions as potential future drug targets. KW - Fluoreszenz-Resonanz-Energie-Transfer KW - RNS KW - MD simulation KW - hybrid modeling KW - GAAA tetraloop Y1 - 2021 UN - https://nbn-resolving.org/urn:nbn:de:bsz:mit1-opus4-122837 SN - 1437-7624 SS - 1437-7624 U6 - https://doi.org/10.48446/opus-12283 DO - https://doi.org/10.48446/opus-12283 IS - 002 SP - 230 EP - 233 S1 - 4 PB - Hochschule Hochschule Mittweida CY - Mittweida ER -