Studi In Silico: Prediksi Potensi 6-shogaol dalam Zingiber officinale sebagai Inhibitor JNK

  • Sri Sulystyaningsih Natalia Daeng Tiring NUSA NIPA UNIVERSITY
    (ID)
  • Yohanes Bare NUSA NIPA UNIVERSITY
    (ID)
  • Andri Maulidi PALANGKA RAYA UNIVERSITY
    (ID)
  • Mansur S Nusa Nipa University
    (ID)
  • Fitra Arya Dwi Nugraha Negeri Padang University
    (ID)

Abstract

Type 2 Diabetes Mellitus (T2DM) is a metabolic disease characterized by hyperglycemia and insulin resistance. T2DM therapy against c-Jun N-terminal kinase (JNK) is one of the recovery solutions using bioactive compounds from ginger. 6-shogaol is bioactive compounds of ginger that has antioxidant properties. The purpose of this study is to analyze the potential of 6-shogaol as a JNK inhibitor. JNK protein (ID: 464Y) was obtained from Protein Data Bank (PDB) through 6-shogaol ligand (CID: 5281794) obtained from the PubChem database. Protein docking protein and ligand use Hex 8.0.0 software while visualization and analysis using Discovery Studio client 4.0. The results showed that 6-shogaol was predicted to have potential as a JNK inhibitor. Proving this by finding five amino acid residues (TRY223, LEU210, THR103 ALA214, ARG107) with an energy of -236.29cal/mol. We found the type of hydrogen bonds and the van der waals forces formed. The interaction of ligand and protein successfully inactivates JNK and stops pancreatic β cell dysfunction. 6-shogaol has pharmacological properties as a JNK,T2DM.

 

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Author Biographies

Sri Sulystyaningsih Natalia Daeng Tiring, NUSA NIPA UNIVERSITY
BIOLOGY EDUCATION STUDY PROGRAM, NUSA NIPA UNIVERSITY
Yohanes Bare, NUSA NIPA UNIVERSITY
CHEMISTRY EDUCATION STUDY PROGRAM, NUSA NIPA UNIVERSITY
Andri Maulidi, PALANGKA RAYA UNIVERSITY
DEPARTMENT OF BIOLOGY, FACULTY OF MATHEMATICS AND NATURAL SCIENCE
Mansur S, Nusa Nipa University
BIOLOGY EDUCATION STUDY PROGRAM, NUSA NIPA UNIVERSITY
Fitra Arya Dwi Nugraha, Negeri Padang University
DEPARTMENT OF BIOLOGY, FACULTY OF MATHEMATICS AND NATURAL SCIENCE

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Published
2019-12-23
How to Cite
Tiring, S. S. N. D., Bare, Y., Maulidi, A., S, M., & Nugraha, F. A. D. (2019). Studi In Silico: Prediksi Potensi 6-shogaol dalam Zingiber officinale sebagai Inhibitor JNK. Al-Kimia, 7(2), 147-153. https://doi.org/10.24252/al-kimia.v7i2.10638
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