ArticleViewAbstractPharmacognosy Journal,2024,16,4,791-796.DOI:10.5530/pj.2024.16.131Published:August 2024Type:Original ArticleIn Silico Gene Transcription of 4-Hydroxycinnamic Acid from Broccoli Fruit (Brassica oleracea var. italica) with Estrogen Receptor Beta ProteinRahadian Zainul, Dheo Shalsabilla Novel, Herland Satriawan, Khang Wen Goh, Vikash Jakhmola, Maksim Rebezov, Sri Suwarni, Ria Septiana, Arif Nur Muhammad Ansori, Mochammad Aqilah Herdiansyah, and Anni Faridah Rahadian Zainul1,2,3*, Dheo Shalsabilla Novel1,2, Herland Satriawan4, Khang Wen Goh5, Vikash Jakhmola6, Maksim Rebezov7,8, Sri Suwarni9, Ria Septiana10, Arif Nur Muhammad Ansori6,11,12,13, Mochammad Aqilah Herdiansyah12,13,14, Anni Faridah15,16 1Department of Chemistry, Faculty of Mathematics and Natural Sciences, Universitas Negeri Padang, Padang, INDONESIA. 2Center for Advanced Material Processing, Artificial Intelligence, and Biophysics Informatics (CAMPBIOTICS), Universitas Negeri Padang, Padang, INDONESIA. 3Research Fellow, INTI International University, 71800, Nilai, Negeri Sembilan, MALAYSIA. 4Institute of Ocean and Earth Sciences, University of Malaya, 50603, Kuala Lumpur, MALAYSIA. 5Faculty of Data Science and Information Technology, INTI International University, Nilai, MALAYSIA. 6Uttaranchal Institute of Pharmaceutical Sciences, Uttaranchal University, Dehradun, INDIA. 7Department of Scientific Research, V. M. Gorbatov Federal Research Center for Food Systems, Moscow, RUSSIA. 8Faculty of Biotechnology and Food Engineering, Ural State Agrarian University, Yekaterinburg, RUSSIA. 9Bachelor of Pharmacy, Nusaputera College of Pharmacy Semarang, INDONESIA. 10Bachelor of Pharmacy, Kendal College of Health Kendal, INDONESIA. 11Postgraduate School, Universitas Airlangga, Surabaya, INDONESIA. 12Virtual Research Center for Bioinformatics and Biotechnology, Surabaya, INDONESIA. 13Division of Research and Development, Jalan Tengah, Surabaya, INDONESIA. 14Department of Biology, Faculty of Science and Technology, Universitas Airlangga, Surabaya, INDONESIA. 15Halal Certification Division, Universitas Negeri Padang, Padang, INDONESIA 16Culinary Innovation Technology, Department of Family Welfare Science, Faculty of Tourism and Hospitality, Universitas Negeri Padang, Padang, INDONESIA Abstract: This study aims to explore the relationship between 4-Hydroxycinnamic Acid, a compound found in broccoli fruit (Brassica oleracea var. italica), and Estrogen Receptor Beta Protein through in silico analysis. The research was conducted using Pymol, MOE 2015, Discovery Studio 2016, and Lepinski Rule software. These tools were employed to model the structure of both the compound and protein, as well as to evaluate their interaction. The results revealed a significant interaction with a Binding Affinity of -6.4182. Moreover, the Root Mean Square Deviation (RMSD) measurements yielded a value of 3.8907, indicating the degree of agreement between the compound and protein structures. Analysis using the Lepinski Rule disclosed the characteristics of the compound 4-Hydroxycinnamic Acid, including a mass of 164, two hydrogen bond donors, three hydrogen bond acceptors, a log P value of 1.490, and a molar reactivity of 44.776. These findings provide valuable insights into the potential of 4-Hydroxycinnamic Acid in interacting with Estrogen Receptor Beta Protein, which could serve as a foundation for further research on the health benefits and therapeutic applications of this compound, contributing to the goal of good health and well-being. Keywords:Brassica oleracea var. italica, good health and well-being., in silico, molecular interactionView:PDF (577.6 KB) PDF Images The interaction results of 4-Hydroxycinnamic Acid. ‹ The Protective Effects of UV-blocking Spectacle Lenses and Class 1 UV-blocking Contact Lenses (Senofilcon A) on Superoxide Dismutase-2 and Catalase Expression in Lens Epithelial Cells Following UVB Radiation Exposure: An Experimental Study in Animal Model up Garcinia cowa Leaf Ethanolic Extract Induces Vasorelaxation Through eNOS/NO/sGC Pathway, Potassium, and Calcium Channels in Isolated Rat Thoracic Aorta ›