Projects funded by the NCN


Information on the principal investigator and host institution

Information of the project and the call

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Mechanistic insights into the specificity of glycosaminoglycan interactions with regulatory proteins

2018/31/G/ST4/00246

Keywords:

protein-glycosaminoglycan interactions specificity electrostatics glycosaminoglycan mimetics nuclear magnetic resonance molecular modeling

Descriptors:

  • ST4_15:
  • ST4_13:
  • ST4_4:

Panel:

ST4 - Chemistry: physical chemistry/chemical physics, theoretical chemistry, analytical chemistry, inorganic chemistry, organic chemistry, method development

Host institution :

Uniwersytet Gdański, Wydział Chemii

woj. pomorskie

Other projects carried out by the institution 

Principal investigator (from the host institution):

dr hab. Sergey Samsonov 

Number of co-investigators in the project: 2

Call: BEETHOVEN 3 - announced on 2018-09-14

Amount awarded: 976 500 PLN

Project start date (Y-m-d): 2020-08-31

Project end date (Y-m-d): 2024-05-30

Project duration:: 45 months (the same as in the proposal)

Project status: Project settled

Project description

Download the project description in a pdf file

Note - project descriptions were prepared by the authors of the applications themselves and placed in the system in an unchanged form.

Information in the final report

  • Publication in academic press/journals (14)
  1. Molecular dynamics-based comparative analysis of chondroitin and dermatan sulfates
    Authors:
    Pągielska M., Samsonov S.A.
    Academic press:
    Biomolecules (rok: 2023, tom: 13, strony: 247), Wydawca: MDPI
    Status:
    Published
    DOI:
    10.3390/biom13020247 - link to the publication
  2. Biglycan Interacts with Type I Insulin-like Receptor (IGF-IR) Signaling Pathway to Regulate Osteosarcoma Cell Growth and Response to Chemotherapy
    Authors:
    Giatagana E-M., Berdiaki A., Gaardløs M., Samsonov S.A., Tzanakakis G.N., Nikitovic D.
    Academic press:
    Cancers (rok: 2022, tom: 14, strony: 1196), Wydawca: MDPI
    Status:
    Published
    DOI:
    10.3390/cancers14051196 - link to the publication
  3. The effect of Pd(II) and Pt(II) coordination on the affinity of avibactam to OXA-48 β-lactamase
    Authors:
    Brzeski J., Nowicka P., Samsonov S.A.
    Academic press:
    European Journal of Medicinal Chemistry Reports (rok: 2023, tom: 9, strony: 100118), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.ejmcr.2023.100118 - link to the publication
  4. Benchmarking Water Models in Molecular Dynamics of Protein−Glycosaminoglycan Complexes
    Authors:
    Anila S., Samsonov S.A.
    Academic press:
    Journal of Chemical Information and Modeling (rok: 2024, tom: 64, strony: 1691-1703), Wydawca: American Chemical Society
    Status:
    Published
    DOI:
    10.1021/acs.jcim.4c00030 - link to the publication
  5. Role of oligosaccharide chain polarity in protein-glycosaminoglycan interactions.
    Authors:
    Bojarski K.K., Samsonov S.A.
    Academic press:
    J Chem Inf Mod (rok: 2021, tom: 61, strony: 455-466), Wydawca: American Chemical Society
    Status:
    Published
    DOI:
    10.1021/acs.jcim.0c01402 - link to the publication
  6. Studying specificity in protein-glycosaminoglycan recognition with umbrella sampling
    Authors:
    Marcicz M., Anila S., Gaardløs M., Zacharias M., Samsonov S.A.
    Academic press:
    Beilstein Journal of Organic Chemistry (rok: 2023, tom: 19, strony: 1933-1946), Wydawca: Beistein Institute
    Status:
    Published
    DOI:
    10.3762/bjoc.19.144 - link to the publication
  7. Extension of the SUGRES-1P Coarse-Grained Model of Polysaccharides to Heparin
    Authors:
    Danielsson A., Samsonov S.A., Liwo A., Sieradzan A.K.
    Academic press:
    Journal of Chemical Theory and Computation (rok: 2023, tom: 17, strony: 6023–6036.), Wydawca: American Chemical Society
    Status:
    Published
    DOI:
    10.1021/acs.jctc.3c00511 - link to the publication
  8. Computational modeling of the molecular basis for the calcium-dependence of the mannuronan C-5 epimerase AvAlgE6 from Azotobacter vinelandii
    Authors:
    Gaardløs M., Lervik A., Samsonov S.A.
    Academic press:
    Computational and Structural Biotechnology Journal (rok: 2023, tom: 21, strony: 2188-2196), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.csbj.2023.03.021 - link to the publication
  9. Molecular dynamics-based descriptors of 3-O-Sulfated Heparan sulfate as contributors of protein binding specificity
    Authors:
    Danielsson A., Kogut M.M., Maszota-Zieleniak M., Chopra P., Boons G.J., Samsonov S.A.
    Academic press:
    Computational Biology and Chemistry (rok: 2022, tom: 99, strony: 107716), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.compbiolchem.2022.107716 - link to the publication
  10. Investigation of hexacyanoferrate(II)/(III) charge-dependent interactions with bovine and human serum albumins
    Authors:
    Grabowska O., Samsonov S.A., Chmurzyński L., Wyrzykowski D., Żamojć K.
    Academic press:
    Spectrochimica Acta Part A (rok: 2023, tom: 293, strony: 122505), Wydawca: Elsevier
    Status:
    Published
    DOI:
    10.1016/j.saa.2023.122505 - link to the publication
  11. Rapamycin- induced autophagy in osteosarcoma cells is mediated via the biglycan/Wnt/β-catenin signaling axis
    Authors:
    Giatagana E-M., Berdiaki A., Gaardløs M., Tsatsakis A., Samsonov S.A., Nikitovic D.
    Academic press:
    American Journal of Physiology-Cell Physiology (rok: 2022, tom: 323, strony: C1740-C1756), Wydawca: American Physiological Society
    Status:
    Published
    DOI:
    10.1152/ajpcell.00368.2022 - link to the publication
  12. Ligand Binding of Interleukin-8: A Comparison of Glycosaminoglycans and Acidic Peptides
    Authors:
    Schulze C., Danielsson A., Liwo A., Huster D., Samsonov S.A., Penk A.
    Academic press:
    Physical Chemistry Chemical Physics (rok: 2023, tom: 25, strony: 24930-24947), Wydawca: Royal Society of Chemistry
    Status:
    Published
    DOI:
    10.1039/d3cp02457a - link to the publication
  13. Role for Carboxylic Acid Moiety in NSAIDs: Favoring the Binding at Site II of Bovine Serum Albumin
    Authors:
    Bertozo L., Tadeu H.S., Sebastian A., Maszota-Zieleniak M., Samsonov S.A., Ximenes V.
    Academic press:
    Molecular Pharmaceutics (rok: 2024, tom: 21, strony: 2501-2511), Wydawca: American Chemical Society
    Status:
    Published
    DOI:
    10.1021/acs.molpharmaceut.4c00044 - link to the publication
  14. Detecting protein-ligand interactions with nitroxide based paramagnetic cosolutes
    Authors:
    Penk A., Danielsson A., Gaardløs M., Montag C., Schöler A., Huster D., Samsonov S.A., Künze G.
    Status:
    Accepted for publication