Removal of Erythrosine B dye from wastewater by Penicillium italicum: experimental, DFT, and molecular docking studies


ÇETİNKAYA S., Eyupoglu V., ÇETİNTAŞ H. İ., YENİDÜNYA A. F., KEBABCI Ö., TÜZÜN B.

Journal of Biomolecular Structure and Dynamics, cilt.41, sa.23, ss.14212-14223, 2023 (SCI-Expanded) identifier identifier identifier

  • Yayın Türü: Makale / Tam Makale
  • Cilt numarası: 41 Sayı: 23
  • Basım Tarihi: 2023
  • Doi Numarası: 10.1080/07391102.2023.2186704
  • Dergi Adı: Journal of Biomolecular Structure and Dynamics
  • Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus, BIOSIS, CAB Abstracts, Chemical Abstracts Core, EMBASE, MEDLINE
  • Sayfa Sayıları: ss.14212-14223
  • Anahtar Kelimeler: Biosorption, DFT, Erythrosine B, molecular docking, Penicillium italicum
  • Sivas Cumhuriyet Üniversitesi Adresli: Evet

Özet

The study involved the adsorption of Erythrosine B onto the dead, dry, and unmodified Penicillium italicum cells and the analytical, visual, theoretical assessment of the adsorbent-adsorbate interactions. It also included desorption studies and reiterative usability of the adsorbent. The fungus was a local isolate and it was identified by partial proteomic experiment in a MALDI-TOFF mass spectrometer. Chemical features of the adsorbent surface were analysed by FT-IR and EDX. Surface topology was visualized by SEM. Isotherm parameters of the adsorption were determined by using three most frequently used models. Erythrosine B appeared to form a monolayer onto the biosorbent and some of the dye molecules could have also penetrated into the adsorbent particles. Kinetic results suggested a spontaneous and exothermic reaction taken place between the dye molecules and the biomaterial. Theoretical approach involved the determination of some of the quantum parameters as well as the toxic or drug potentials of the some of the components of the biomaterial.