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All Journal RADIASI: Jurnal Berkala Pendidikan Fisika Berkala Kedokteran IJISTECH (International Journal Of Information System & Technology) Jurnal Review Pendidikan dan Pengajaran (JRPP) IJISTECH Bulletin of Computer Science Research Jurnal Manajemen Mandiri Saburai (JMMS) Prosiding Seminar Nasional Program Pengabdian Masyarakat Jurnal Ekonomika Dan Bisnis Herbal Medicine Journal Physics Learning and Education PENG: Jurnal Ekonomi dan Manajemen
Saputri, Indah
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Agriculture, Biological Sciences & Forestry Biochemistry, Genetics & Molecular Biology Chemical Engineering, Chemistry & Bioengineering Computer Science & IT Decision Sciences, Operations Research & Management Economics, Econometrics & Finance Education Electrical & Electronics Engineering Engineering Health Professions Immunology & microbiology Languange, Linguistic, Communication & Media Medicine & Pharmacology Physics Public Health Social Sciences Other

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Journal : Berkala Kedokteran

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Potential of Chemical Compounds from Coloring Plants (Stenochlaena palutris) as Competitors for ALK Protein Damage Due To Pesticide Exposure: In Silico Study Sarmila, Sarmila; Nafisah, Nafisah; Habibah, Hanna; Saputri, Indah; Setiawati, Indah; Komari, Noer
Berkala Kedokteran Vol 19, No 2 (2023)
Publisher : Fakultas Kedokteran Universitas Lambung Mangkurat

Show Abstract | Download Original | Original Source | Check in Google Scholar | DOI: 10.20527/jbk.v19i2.17415

Abstract

Pesticide active ingredients have widespread toxicity effects on target and non-target organisms. Continuous exposure to pesticides causes cancer. Kelakai is thought to have potential cytotoxic activity against the growth of cancer cells. The aim of this research is to examine the potential activity of chemical compounds on Anaplastic Lymphoma Kinase (ALK) proteins exposed to organophosphate pesticides in silico. Protein and ligand preparation with the Chimera program, Docking using SwissDock, as well as virtual screening using the pkCSM web and ProTox. Ethion and neophytadiene have the most negative ∆G values of -8.62 kcal/mol and -8.39 kcal/mol, respectively. The binding site for ethion and neophytadiene compounds with the ALK protein is right at the active site of the ALK protein. Ethion is the most toxic organophosphate pesticide and has the potential to be cytogenic. Neophytadiene from kelakai compounds has the potential to act as a competitor in inhibiting the ALK protein. The similarity in the type and number of binding residues in ethion and neophytadiene in the ALK protein indicates competition between ethion and neophytadiene.
Co-Authors Afdella, Nor Afni An’nisa, Windy Sidratul Ariza, Dida Rayhan Asrizal Atmaja, Faisal Azhar, Thariq Chairina Chairina, Chairina Fadillah, Roojil Farhani, Putri Fatni Mufit Feziyasti, Azifa Habibah, Hanna Heri Santoso Indah Setiawati Mahmudah, Fajira Matanari, Hanif Kurniawan Muhamad Alda Muhammad Alfarisi Muhammad Dedi Irawan Mukarramah Mukarramah, Mukarramah Nafisah Nafisah Noer Komari Permana, Andhika Cahya Praseptian, Fidela Locita Purnomo, Kristiana Felisia Raissa Amanda Putri Ramadhanti, Ayona Wulan Rifai, Faizal S, Vinna Rahmayanti Sarmila, Sarmila Setyaningsih Tyas, Woro Wiwaraning Yufis Azhar