STUDI DOCKING MOLEKULAR SENYAWA KUERSETIN, KALKON DAN TURUNANNYA SEBAGAI INHIBITOR SEL KANKER PAYUDARA MC-7 (MICHIGAN CANCER FOUNDATION-7)

  • Resy Lelita FMIPA
  • Rahmat Gunawan
  • Winni Astuti

Abstract

Molecular Docking studies Quercetin, Chalcone and its derivate inhibitor to breast cancer cells MCF-7 (Michigan Cancer Foundation-7) have been done. The results showed that the docking energies after the process of binding on mode 1 of four compounds Quersetin -7.4 Kcal/mol, 2-(3,4-dihidroksifenil)-5,7-dihidroksi-3-metoksi-3,4-dihidro-2H-1-benzopyran-4-on -6.8 Kcal/mol, Chalcone -6.7 Kcal/mol and 3-(2,4-dihidroksifenil)-1-fenilpropan-1-on -6.6 Kcal/mol. Quercetin formed hydrogen bondings with amino acid  of Aspartic Acid 61, Arginine 65, Arginine 68, Fenilalanin 71 and Serin 75. , 2-(3,4-dihidroksifenil)-5,7-dihidroksi-3-metoksi-3,4-dihidro-2H-1-benzopyran-4-on formed hydrogen bondings with amino acid of Alanin 59, Asparagine 102 dan Arginine 105. Chalcone formed hydrogen bondings with amino acid of Glitamic Acid 94 and 3-(2,4-dihidroksifenil)-1-fenilpropan-1-on formed hydrogen bondings with amino acid of Tyrosine 67. Quercetin is as potential than anticancer drug than chalcone, -(3,4-dihidroksifenil)-5,7-dihidroksi-3-metoksi-3,4-dihidro-2H-1-benzopyran-4-on and 3-(2,4-dihidroksifenil)-1-fenilpropan-1-on.
Keyword
Breast Cancer, Molecular Docking, Quersetin, Kalkon, Protein Breast Cancer Cells MCF-7 (Michigan Cancer Foundation-7)

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References

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Published
2019-11-29
How to Cite
LELITA, Resy; GUNAWAN, Rahmat; ASTUTI, Winni. STUDI DOCKING MOLEKULAR SENYAWA KUERSETIN, KALKON DAN TURUNANNYA SEBAGAI INHIBITOR SEL KANKER PAYUDARA MC-7 (MICHIGAN CANCER FOUNDATION-7). JURNAL KIMIA MULAWARMAN, [S.l.], v. 17, n. 1, p. 24-30, nov. 2019. ISSN 2476-9258. Available at: <http://jurnal.kimia.fmipa.unmul.ac.id/index.php/JKM/article/view/460>. Date accessed: 09 apr. 2020. doi: https://doi.org/10.30872/jkm.v17i1.460.
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