Synthesis, crystal structure and molecular docking analysis of a copper(ii) coordination polymer based on 1,10- phenanthroline and BENZENE-1,2-DICARBOXYLIC acid

Ibragimova, Asal Xurshidjon qizi, Turaev, Khayit Khudaynazarovich, Saidov, Dilmurod Khursan ugli, U.U., Ruziev Umid Ural ugli

Қўқон ДПИ. Илмий хабарлар · 2026-yil

Annotatsiya

A copper (II) coordination polymer, [Cu(phen)(bdc)]n, was synthesized and characterized using single-crystal X-ray diffraction, BFDH crystal morphology analysis, and molecular docking calculations. The main objective was to determine its crystal structure and Cu (II) coordination environment and to examine its interactions with selected bacterial proteins. In the crystal structure, the Cu (II) centre is coordinated by two nitrogen atoms of the chelating 1,10-phenanthroline ligand and oxygen atoms of benzene-1,2-dicarboxylate (bdc2-). The bdc2- ligands bridge neighbouring Cu (II) centres, producing an extended coordination-polymer structure. BFDH calculations showed a distinct polyhedral crystal morphology defined by several crystallographic faces. Molecular docking was carried out using PBP2a, FtsZ, PBP3, and GyrB from S. aureus, B. subtilis, P. aeruginosa, and E. coli, respectively. The calculated binding affinities ranged from -7.1 to -9.4 kcal/mol. Hydrogen bonding, electrostatic, aromatic, hydrophobic, and van der Waals interactions contributed to the stabilization of the complexes.

Maqola ma’lumotlari
MualliflarIbragimova, Asal Xurshidjon qizi, Turaev, Khayit Khudaynazarovich, Saidov, Dilmurod Khursan ugli, U.U., Ruziev Umid Ural ugli
JurnalҚўқон ДПИ. Илмий хабарлар
NashriyotҚўқон давлат педагогика институти
ISSN3030-3958
Nashr sanasi2026-10-10
Jild8
Son9
Betlar1150-1159
TilIngliz
DOI10.70728/a.series.tab.v08.i09.151
Indeksga qo‘shilgan2026-10-11

DOI: 10.70728/a.series.tab.v08.i09.151 · Maqolaning asl sahifasi

Kalit so‘zlar

Copper (II) coordination polymer, 1, 10-phenanthroline, crystal structure, BFDH morphology, molecular docking.

Iqtibos keltirish

APAIbragimova, Asal Xurshidjon qizi, Turaev, Khayit Khudaynazarovich, Saidov, Dilmurod Khursan ugli, & U.U., Ruziev Umid Ural ugli (2026). SYNTHESIS, CRYSTAL STRUCTURE AND MOLECULAR DOCKING ANALYSIS OF A COPPER(II) COORDINATION POLYMER BASED ON 1,10- PHENANTHROLINE AND BENZENE-1,2-DICARBOXYLIC ACID. Қўқон ДПИ. Илмий хабарлар, 8(9), 1150-1159. https://doi.org/10.70728/a.series.tab.v08.i09.151
GOST (OAK)Ibragimova, Asal Xurshidjon qizi va b. SYNTHESIS, CRYSTAL STRUCTURE AND MOLECULAR DOCKING ANALYSIS OF A COPPER(II) COORDINATION POLYMER BASED ON 1,10- PHENANTHROLINE AND BENZENE-1,2-DICARBOXYLIC ACID // Қўқон ДПИ. Илмий хабарлар. – 2026. – T. 8, № 9. – P. 1150-1159. – DOI: 10.70728/a.series.tab.v08.i09.151.
MLAIbragimova, Asal Xurshidjon qizi, Turaev, Khayit Khudaynazarovich, Saidov, Dilmurod Khursan ugli, and U.U., Ruziev Umid Ural ugli. “SYNTHESIS, CRYSTAL STRUCTURE AND MOLECULAR DOCKING ANALYSIS OF A COPPER(II) COORDINATION POLYMER BASED ON 1,10- PHENANTHROLINE AND BENZENE-1,2-DICARBOXYLIC ACID.” Қўқон ДПИ. Илмий хабарлар, 8(9), 1150-1159, 2026. https://doi.org/10.70728/a.series.tab.v08.i09.151
ChicagoIbragimova, Asal Xurshidjon qizi, Turaev, Khayit Khudaynazarovich, Saidov, Dilmurod Khursan ugli, and U.U., Ruziev Umid Ural ugli. “SYNTHESIS, CRYSTAL STRUCTURE AND MOLECULAR DOCKING ANALYSIS OF A COPPER(II) COORDINATION POLYMER BASED ON 1,10- PHENANTHROLINE AND BENZENE-1,2-DICARBOXYLIC ACID.” Қўқон ДПИ. Илмий хабарлар, 8(9), 1150-1159 (2026). https://doi.org/10.70728/a.series.tab.v08.i09.151
HarvardIbragimova, Asal Xurshidjon qizi, Turaev, Khayit Khudaynazarovich, Saidov, Dilmurod Khursan ugli, and U.U., Ruziev Umid Ural ugli (2026) ‘SYNTHESIS, CRYSTAL STRUCTURE AND MOLECULAR DOCKING ANALYSIS OF A COPPER(II) COORDINATION POLYMER BASED ON 1,10- PHENANTHROLINE AND BENZENE-1,2-DICARBOXYLIC ACID’, Қўқон ДПИ. Илмий хабарлар, 8(9), 1150-1159. https://doi.org/10.70728/a.series.tab.v08.i09.151
BibTeX
@article{ibragimovaasalxurshidjonqizi2026,
  title = {SYNTHESIS, CRYSTAL STRUCTURE AND MOLECULAR DOCKING ANALYSIS OF A COPPER(II) COORDINATION POLYMER BASED ON 1,10- PHENANTHROLINE AND BENZENE-1,2-DICARBOXYLIC ACID},
  author = {Ibragimova, Asal Xurshidjon qizi and Turaev, Khayit Khudaynazarovich and Saidov, Dilmurod Khursan ugli and U.U., Ruziev Umid Ural ugli},
  journal = {Қўқон ДПИ. Илмий хабарлар},
  year = {2026},
  volume = {8},
  number = {9},
  pages = {1150-1159},
  doi = {10.70728/a.series.tab.v08.i09.151},
  url = {https://doi.org/10.70728/a.series.tab.v08.i09.151}
}

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