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| 001 | 1006781 | ||
| 005 | 20240625095118.0 | ||
| 024 | 7 | _ | |a 10.1101/2023.03.10.531864 |2 doi |
| 024 | 7 | _ | |a 2128/34309 |2 Handle |
| 037 | _ | _ | |a FZJ-2023-01834 |
| 082 | _ | _ | |a 570 |
| 100 | 1 | _ | |a Dorn, Anton |0 P:(DE-Juel1)188441 |b 0 |
| 245 | _ | _ | |a Impact of Phosphorylation on alpha-Synuclein Structural Determinants |
| 260 | _ | _ | |a Cold Spring Harbor |c 2023 |b Cold Spring Harbor Laboratory, NY |
| 336 | 7 | _ | |a Preprint |b preprint |m preprint |0 PUB:(DE-HGF)25 |s 1681794592_7108 |2 PUB:(DE-HGF) |
| 336 | 7 | _ | |a WORKING_PAPER |2 ORCID |
| 336 | 7 | _ | |a Electronic Article |0 28 |2 EndNote |
| 336 | 7 | _ | |a preprint |2 DRIVER |
| 336 | 7 | _ | |a ARTICLE |2 BibTeX |
| 336 | 7 | _ | |a Output Types/Working Paper |2 DataCite |
| 520 | _ | _ | |a Serine 129 and, to a lesser extent, serine 87 can appear phosphorylated in the intrinsically disordered protein human α-synuclein (AS), a key player in Parkinson’s disease, where it accumulates in proteinaceous aggregates. Intriguingly, both phosphorylations are located in a highly negative potential region of the protein. Here we used molecular simulation to provide insight in the selective phosphorylation by polo-like kinase 2 (PLK2), in both monomeric and fibrillar forms of AS. We suggest that phosphorylation does not impact on the structural determinants of the physiological AS conformational ensemble, as the phosphate group is mostly solvated. Our findings are consistent with experimental data on the non-acetylated, non-physiological form of the protein. The phosphate groups of pAS may be solvated also in the aggregated form. |
| 536 | _ | _ | |a 5111 - Domain-Specific Simulation & Data Life Cycle Labs (SDLs) and Research Groups (POF4-511) |0 G:(DE-HGF)POF4-5111 |c POF4-511 |f POF IV |x 0 |
| 536 | _ | _ | |a HDS LEE - Helmholtz School for Data Science in Life, Earth and Energy (HDS LEE) (HDS-LEE-20190612) |0 G:(DE-Juel1)HDS-LEE-20190612 |c HDS-LEE-20190612 |x 1 |
| 588 | _ | _ | |a Dataset connected to CrossRef |
| 700 | 1 | _ | |a de Bruyn, Emile |0 P:(DE-Juel1)184777 |b 1 |
| 700 | 1 | _ | |a Rossetti, Giulia |0 P:(DE-Juel1)145921 |b 2 |e Corresponding author |
| 700 | 1 | _ | |a Fernandez, Claudio |0 0000-0003-0454-7735 |b 3 |
| 700 | 1 | _ | |a Outeiro, Tiago F. |0 0000-0003-1679-1727 |b 4 |
| 700 | 1 | _ | |a Schulz, Jörg B. |0 P:(DE-Juel1)171786 |b 5 |
| 700 | 1 | _ | |a Carloni, Paolo |0 P:(DE-Juel1)145614 |b 6 |
| 773 | _ | _ | |a 10.1101/2023.03.10.531864 |0 PERI:(DE-600)2766415-6 |t bioRxiv beta |y 2023 |
| 856 | 4 | _ | |u https://www.biorxiv.org/content/10.1101/2023.03.10.531864v2 |
| 856 | 4 | _ | |u https://juser.fz-juelich.de/record/1006781/files/2023.03.10.531864.full.pdf |y OpenAccess |
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| 914 | 1 | _ | |y 2023 |
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| 980 | _ | _ | |a preprint |
| 980 | _ | _ | |a VDB |
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