Complex Biophysical and Computational Analyses of GQuadruplex Ligands: The Porphyrin Stacks Back
dc.contributor.author | Satta, Giuseppe | cs |
dc.contributor.author | Trajkovski, Marko | cs |
dc.contributor.author | Cantara, Alessio | cs |
dc.contributor.author | Mura, Monica | cs |
dc.contributor.author | Meloni, Claudia | cs |
dc.contributor.author | Olla, Giulia | cs |
dc.contributor.author | Dobrovolná, Michaela | cs |
dc.contributor.author | Pisano, Luisa | cs |
dc.contributor.author | Gaspa, Silvia | cs |
dc.contributor.author | Salis, Andrea | cs |
dc.contributor.author | De Luca, Lidia | cs |
dc.contributor.author | Mocci, Francesca | cs |
dc.contributor.author | Brázda, Václav | cs |
dc.contributor.author | Plavec, Janez | cs |
dc.contributor.author | Carraro, Massimo | cs |
dc.coverage.issue | 69 | cs |
dc.coverage.volume | 30 | cs |
dc.date.accessioned | 2025-04-04T11:56:20Z | |
dc.date.available | 2025-04-04T11:56:20Z | |
dc.date.issued | 2024-09-18 | cs |
dc.description.abstract | G-quadruplexes (G4 s), as non-canonical DNA structures, attracta great deal of research interest in the molecular biology as wellas in the material science fields. The use of small molecules asligands for G-quadruplexes has emerged as a tool to regulategene expression and telomeres maintenance. Meso-tetrakis-(N-methyl-4-pyridyl) porphyrin (TMPyP4) was shown as one of thefirst ligands for G-quadruplexes and it is still widely used. Wereport an investigation comprising molecular docking anddynamics, synthesis and multiple spectroscopic and spectro-metric determinations on simple cationic porphyrins and theirinteraction with different DNA sequences. This study enabledthe synthesis of tetracationic porphyrin derivatives that ex-hibited binding and stabilizing capacity against G-quadruplexstructures; the detailed characterization has shown that thepresence of amide groups at the periphery improves selectivityfor parallel G4 s binding over other structures. Taking intoaccount the ease of synthesis, 5,10,15,20-tetrakis-(1-acetamido-4-pyridyl) porphyrin bromide could be considered a betteralternative to TMPyP4 in studies involving G4 binding. | en |
dc.format | text | cs |
dc.format.extent | 1-13 | cs |
dc.format.mimetype | application/pdf | cs |
dc.identifier.citation | CHEMISTRY-A EUROPEAN JOURNAL. 2024, vol. 30, issue 69, p. 1-13. | en |
dc.identifier.doi | 10.1002/chem.202402600 | cs |
dc.identifier.issn | 0947-6539 | cs |
dc.identifier.orcid | 0000-0003-2837-4226 | cs |
dc.identifier.other | 190100 | cs |
dc.identifier.researcherid | F-9582-2011 | cs |
dc.identifier.uri | https://hdl.handle.net/11012/250725 | |
dc.language.iso | en | cs |
dc.publisher | Wiley-VCH | cs |
dc.relation.ispartof | CHEMISTRY-A EUROPEAN JOURNAL | cs |
dc.relation.uri | https://chemistry-europe.onlinelibrary.wiley.com/doi/10.1002/chem.202402600 | cs |
dc.rights | Creative Commons Attribution-NonCommercial-NoDerivatives 4.0 International | cs |
dc.rights.access | openAccess | cs |
dc.rights.sherpa | http://www.sherpa.ac.uk/romeo/issn/0947-6539/ | cs |
dc.rights.uri | http://creativecommons.org/licenses/by-nc-nd/4.0/ | cs |
dc.subject | DNA | en |
dc.subject | G-quadruplexes | en |
dc.subject | Molecular dynamics | en |
dc.subject | Molecular recognition | en |
dc.subject | NMR | en |
dc.title | Complex Biophysical and Computational Analyses of GQuadruplex Ligands: The Porphyrin Stacks Back | en |
dc.type.driver | article | en |
dc.type.status | Peer-reviewed | en |
dc.type.version | publishedVersion | en |
sync.item.dbid | VAV-190100 | en |
sync.item.dbtype | VAV | en |
sync.item.insts | 2025.04.04 13:56:20 | en |
sync.item.modts | 2025.03.31 13:32:04 | en |
thesis.grantor | Vysoké učení technické v Brně. Fakulta chemická. Ústav chemie potravin a biotechnologií | cs |
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