% IMPORTANT: The following is UTF-8 encoded. This means that in the presence % of non-ASCII characters, it will not work with BibTeX 0.99 or older. % Instead, you should use an up-to-date BibTeX implementation like “bibtex8” or % “biber”. @ARTICLE{AlfonsoPrieto:862342, author = {Alfonso-Prieto, Mercedes and Giorgetti, Alejandro and Carloni, Paolo}, title = {{M}ultiscale simulations on human {F}rizzled and {T}aste2 {GPCR}s}, journal = {Current opinion in structural biology}, volume = {55}, issn = {0959-440X}, address = {Amsterdam [u.a.]}, publisher = {Elsevier}, reportid = {FZJ-2019-02680}, pages = {8-16}, year = {2019}, abstract = {Recently, molecular dynamics simulations, from all atom and coarse grained to hybrid methods bridging the two scales, have provided exciting functional insights into class F (Frizzled and Taste2) GPCRs (about 40 members in humans). Findings include: (i) The activation of one member of the Frizzled receptors (FZD4) involves a bending of transmembrane helix TM7 far larger than that in class A GPCRs. (ii) The affinity of an anticancer drug targeting another member (Smoothened receptor) decreases in a specific drug-resistant variant, because the mutation ultimately disrupts the binding cavity and affects TM6. (iii) A novel two-state recognition mechanism explains the very large agonist diversity for at least one member of the Taste2 GPCRs, hTAS2R46.}, cin = {IAS-5 / INM-9}, ddc = {570}, cid = {I:(DE-Juel1)IAS-5-20120330 / I:(DE-Juel1)INM-9-20140121}, pnm = {574 - Theory, modelling and simulation (POF3-574)}, pid = {G:(DE-HGF)POF3-574}, typ = {PUB:(DE-HGF)16}, pubmed = {pmid:30933747}, UT = {WOS:000482514400004}, doi = {10.1016/j.sbi.2019.02.009}, url = {https://juser.fz-juelich.de/record/862342}, }