Zobrazeno 1 - 10
of 14
pro vyhledávání: '"Weronika Bagrowska"'
Autor:
Emilia Martula, Beata Morak-Młodawska, Małgorzata Jeleń, Paulina Strzyga-Łach, Marta Struga, Katarzyna Żurawska, Anna Kasprzycka, Weronika Bagrowska
Publikováno v:
Applied Sciences, Vol 14, Iss 16, p 7263 (2024)
Dimers of dipyridothiazines with an m-xylene moiety are presented in terms of a comparative analysis with anticancer active structural analogs containing a lutidine system. The synthesis of new isomeric dimers was described, the structure of which wa
Externí odkaz:
https://doaj.org/article/fee74264e36a48d4bcf5eddf2089f070
Autor:
Karolina Mitusińska, Piotr Wojsa, Maria Bzówka, Agata Raczyńska, Weronika Bagrowska, Aleksandra Samol, Patryk Kapica, Artur Góra
Publikováno v:
Computational and Structural Biotechnology Journal, Vol 20, Iss , Pp 193-205 (2022)
Enzymes with buried active sites maintain their catalytic function via a single tunnel or tunnel network. In this study we analyzed the functionality of soluble epoxide hydrolases (sEHs) tunnel network, by comparing the overall enzyme structure with
Externí odkaz:
https://doaj.org/article/def315439ad94a25a586b45f7119cde7
Autor:
Maria Bzówka, Karolina Mitusińska, Agata Raczyńska, Tomasz Skalski, Aleksandra Samol, Weronika Bagrowska, Tomasz Magdziarz, Artur Góra
Publikováno v:
PLoS Computational Biology, Vol 18, Iss 5, p e1010119 (2022)
The evolutionary variability of a protein's residues is highly dependent on protein region and function. Solvent-exposed residues, excluding those at interaction interfaces, are more variable than buried residues whereas active site residues are cons
Externí odkaz:
https://doaj.org/article/9a363a48ce7e4d71898579d0ae0eb9b1
Publikováno v:
Computational and Structural Biotechnology Journal, Vol 18, Iss , Pp 355-365 (2020)
Water molecules maintain proteins’ structures, functions, stabilities and dynamics. They can occupy certain positions or pass quickly via a protein’s interior. Regardless of their behaviour, water molecules can be used for the analysis of protein
Externí odkaz:
https://doaj.org/article/e0da40d7445146adb4300dbaed5fb31c
Autor:
Karolina Mitusińska, Piotr Wojsa, Maria Bzówka, Agata Raczyńska, Weronika Bagrowska, Aleksandra Samol, Patryk Kapica, Artur Góra
Publikováno v:
Computational and Structural Biotechnology Journal, Vol 20, Iss , Pp 2198-2199 (2022)
Externí odkaz:
https://doaj.org/article/58a5b072c71e4615b029fcc215c2866c
Autor:
Katarzyna Papaj, Patrycja Spychalska, Katarzyna Hopko, Patryk Kapica, Andre Fisher, Markus A. Lill, Weronika Bagrowska, Jakub Nowak, Katarzyna Szleper, Martin Smieško, Anna Kasprzycka, Artur Góra
Publikováno v:
Pharmaceuticals, Vol 14, Iss 11, p 1153 (2021)
In the present study we tested, using the microscale thermophoresis technique, a small library of thionocarbamates, thiolocarbamates, sulfide and disulfide as potential lead compounds for SARS-CoV-2 Mpro drug design. The successfully identified binde
Externí odkaz:
https://doaj.org/article/cfc8ba5fbeaa4b28b89a3a1f556103ea
AlphaFold - a game changer for accurate protein structure prediction was tested on metamorphic proteins, which display two or more distinct folds while having the same sequence. We highlighted the limitations of the method and suggested careful inves
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::3915f98cca6acd5e4cf445f6b04a81e2
https://doi.org/10.26434/chemrxiv-2023-4nlrs
https://doi.org/10.26434/chemrxiv-2023-4nlrs
Toll-like receptors (TLRs) are transmembrane proteins which recognise various molecular patterns and activate signalling that triggers the immune response. In this review, our goal was to summarise how, in recent years, various computational solution
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6638bcb447b2228e9b866a9da769367b
https://doi.org/10.26434/chemrxiv-2023-4zp5t-v3
https://doi.org/10.26434/chemrxiv-2023-4zp5t-v3
Autor:
Karolina Mitusińska, Piotr Wojsa, Maria Bzówka, Agata Raczyńska, Weronika Bagrowska, Aleksandra Samol, Patryk Kapica, Artur Góra
Publikováno v:
Computational and Structural Biotechnology Journal
Comput Struct Biotechnol J
Computational and Structural Biotechnology Journal, Vol 20, Iss, Pp 193-205 (2022)
Comput Struct Biotechnol J
Computational and Structural Biotechnology Journal, Vol 20, Iss, Pp 193-205 (2022)
Graphical abstract
Highlights • Lineage of a sEH determines its overall flexibility and tunnels architecture. • sEHs flexibility and tunnel network regulate substrate positioning. • Extensive tunnel network can be substantial for hydrolyti
Highlights • Lineage of a sEH determines its overall flexibility and tunnels architecture. • sEHs flexibility and tunnel network regulate substrate positioning. • Extensive tunnel network can be substantial for hydrolyti
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::10cbd7d5595ecd3c8eaa99a2b33b1dc7
http://europepmc.org/articles/PMC8715294
http://europepmc.org/articles/PMC8715294
Publikováno v:
Computational and Structural Biotechnology Journal
Computational and Structural Biotechnology Journal, Vol 18, Iss, Pp 355-365 (2020)
Computational and Structural Biotechnology Journal, Vol 18, Iss, Pp 355-365 (2020)
Graphical abstract
Water molecules maintain proteins’ structures, functions, stabilities and dynamics. They can occupy certain positions or pass quickly via a protein’s interior. Regardless of their behaviour, water molecules can be used for
Water molecules maintain proteins’ structures, functions, stabilities and dynamics. They can occupy certain positions or pass quickly via a protein’s interior. Regardless of their behaviour, water molecules can be used for
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::854a1dc0d2e2c8cc4f1f2a758861c944
https://doi.org/10.1016/j.csbj.2020.02.001
https://doi.org/10.1016/j.csbj.2020.02.001