eprintid: 41519
rev_number: 7
eprint_status: archive
userid: 2310
dir: disk0/00/04/15/19
datestamp: 2025-01-30 04:09:29
lastmod: 2025-01-30 04:09:29
status_changed: 2025-01-30 04:09:29
type: thesis
metadata_visibility: show
creators_name: Rizky, Arcinthya Rachmania
creators_name: Supandi, Supandi
title: SIMULASI PENAMBATAN MOLEKULER DAN DINAMIKA MOLEKULER
SENYAWA EKSTRAK ROSEMARI (Rosmarinus officinalis L. ) TERHADAP
ERα SEBAGAI ANTI KANKER PAYUDARA
ispublished: pub
subjects: RS
divisions: 48201
abstract: SIMULASI PENAMBATAN MOLEKULER DAN DINAMIKA MOLEKULER
SENYAWA EKSTRAK ROSEMARI (Rosmarinus officinalis L.) TERHADAP
ERα SEBAGAI ANTI KANKER PAYUDARA
Rahman Sadli Waraiya
1504015310
Kanker payudara merupakan penyakit kanker yang paling sering diderita oleh wanita
dan merupakan penyakit kanker dengan jumlah kasus baru terbanyak di dunia pada
tahun 2020. Ekstrak Rosemari diketahui memilki potensi sebagai antikanker payudara
karena menghambat ERα pada sel T-47D dan sel MCF-7 dengan IC50 masing-masing
sebesar 38,3 ± 2,8 μg/mL dan 65,5 ± 8,7 μg /mL. Penelitian ini bertujuan untuk
menguji afinitas dan kestabilan senyawa Rosemari terhadap ERα sebagai antikanker
payudara dengan metode penambatan molekuler dan dinamika molekuler.
Penambatan molekuler dilakukan menggunakan Autodock 4.0 dan dinamika
molekuler menggunakan Gromacs. Hasil penambatan molekuler menunjukan
Kariofilen Oksida memiliki nilai afinitas sebesar -7,70 kkal/mol sedangkan tamoxifen
sebagai kontrol positif sebesar -10,33 kkal/mol. Hasil dinamika molekuler
menunjukan kompleks protein Kariofolen oksida memiliki nilai energi potensial dan
Root Mean Square Distance (RMSD) yang stabil sedangkan nilai Root Mean Square
Fluctuation (RMSF), Radius of Gyration, ikatan hidrogen dan energi energi bebas
(ΔG) dengan metode Molecular Mechanics Poisson–Boltzmann Surface Area
(MMPBSA) menunjukan kompleks protein Kariofilen Oksida tidak lebih stabil
dibandingkan kompleks protein tamoxifen.
Kata Kunci : Ekstrak Rosemari, Kanker Payudara, Penambatan molekuler, Reseptor
estrogen alfa (Erα), Simulasi dinamika molekuler, Tamoxifen
date: 2024
date_type: completed
full_text_status: public
institution: UNIVERSITAS MUHAMMADIYAH PROF. DR. HAMKA
department: Fakultas Farmasi Dan Sains
thesis_type: bachelor
thesis_name: bphil
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citation:   Rizky, Arcinthya Rachmania dan Supandi, Supandi  (2024) SIMULASI PENAMBATAN MOLEKULER DAN DINAMIKA MOLEKULER SENYAWA EKSTRAK ROSEMARI (Rosmarinus officinalis L. ) TERHADAP ERα SEBAGAI ANTI KANKER PAYUDARA.  Bachelor thesis, UNIVERSITAS MUHAMMADIYAH PROF. DR. HAMKA.   
document_url: http://repository.uhamka.ac.id/id/eprint/41519/1/FS03-240111.pdf