Advances and Mechanisms of RNA–Ligand Interaction Predictions

The diversity and complexity of RNA include sequence, secondary structure, and tertiary structure characteristics. These elements are crucial for RNA’s specific recognition of other molecules. With advancements in biotechnology, RNA–ligand structures allow researchers to utilize experimental data to...

Full description

Saved in:
Bibliographic Details
Main Authors: Chen Zhuo, Chengwei Zeng, Haoquan Liu, Huiwen Wang, Yunhui Peng, Yunjie Zhao
Format: Article
Language:English
Published: MDPI AG 2025-01-01
Series:Life
Subjects:
Online Access:https://www.mdpi.com/2075-1729/15/1/104
Tags: Add Tag
No Tags, Be the first to tag this record!
_version_ 1832588156154675200
author Chen Zhuo
Chengwei Zeng
Haoquan Liu
Huiwen Wang
Yunhui Peng
Yunjie Zhao
author_facet Chen Zhuo
Chengwei Zeng
Haoquan Liu
Huiwen Wang
Yunhui Peng
Yunjie Zhao
author_sort Chen Zhuo
collection DOAJ
description The diversity and complexity of RNA include sequence, secondary structure, and tertiary structure characteristics. These elements are crucial for RNA’s specific recognition of other molecules. With advancements in biotechnology, RNA–ligand structures allow researchers to utilize experimental data to uncover the mechanisms of complex interactions. However, determining the structures of these complexes experimentally can be technically challenging and often results in low-resolution data. Many machine learning computational approaches have recently emerged to learn multiscale-level RNA features to predict the interactions. Predicting interactions remains an unexplored area. Therefore, studying RNA–ligand interactions is essential for understanding biological processes. In this review, we analyze the interaction characteristics of RNA–ligand complexes by examining RNA’s sequence, secondary structure, and tertiary structure. Our goal is to clarify how RNA specifically recognizes ligands. Additionally, we systematically discuss advancements in computational methods for predicting interactions and to guide future research directions. We aim to inspire the creation of more reliable RNA–ligand interaction prediction tools.
format Article
id doaj-art-b3f1dda8da0a476fa8e0499d2e55861e
institution Kabale University
issn 2075-1729
language English
publishDate 2025-01-01
publisher MDPI AG
record_format Article
series Life
spelling doaj-art-b3f1dda8da0a476fa8e0499d2e55861e2025-01-24T13:38:48ZengMDPI AGLife2075-17292025-01-0115110410.3390/life15010104Advances and Mechanisms of RNA–Ligand Interaction PredictionsChen Zhuo0Chengwei Zeng1Haoquan Liu2Huiwen Wang3Yunhui Peng4Yunjie Zhao5Institute of Biophysics and Department of Physics, Central China Normal University, Wuhan 430079, ChinaInstitute of Biophysics and Department of Physics, Central China Normal University, Wuhan 430079, ChinaInstitute of Biophysics and Department of Physics, Central China Normal University, Wuhan 430079, ChinaSchool of Physics and Engineering, Henan University of Science and Technology, Luoyang 471023, ChinaInstitute of Biophysics and Department of Physics, Central China Normal University, Wuhan 430079, ChinaInstitute of Biophysics and Department of Physics, Central China Normal University, Wuhan 430079, ChinaThe diversity and complexity of RNA include sequence, secondary structure, and tertiary structure characteristics. These elements are crucial for RNA’s specific recognition of other molecules. With advancements in biotechnology, RNA–ligand structures allow researchers to utilize experimental data to uncover the mechanisms of complex interactions. However, determining the structures of these complexes experimentally can be technically challenging and often results in low-resolution data. Many machine learning computational approaches have recently emerged to learn multiscale-level RNA features to predict the interactions. Predicting interactions remains an unexplored area. Therefore, studying RNA–ligand interactions is essential for understanding biological processes. In this review, we analyze the interaction characteristics of RNA–ligand complexes by examining RNA’s sequence, secondary structure, and tertiary structure. Our goal is to clarify how RNA specifically recognizes ligands. Additionally, we systematically discuss advancements in computational methods for predicting interactions and to guide future research directions. We aim to inspire the creation of more reliable RNA–ligand interaction prediction tools.https://www.mdpi.com/2075-1729/15/1/104RNA secondary structure motifsRNA pocket geometric featureRNA–ligand interaction mechanismstructure prediction
spellingShingle Chen Zhuo
Chengwei Zeng
Haoquan Liu
Huiwen Wang
Yunhui Peng
Yunjie Zhao
Advances and Mechanisms of RNA–Ligand Interaction Predictions
Life
RNA secondary structure motifs
RNA pocket geometric feature
RNA–ligand interaction mechanism
structure prediction
title Advances and Mechanisms of RNA–Ligand Interaction Predictions
title_full Advances and Mechanisms of RNA–Ligand Interaction Predictions
title_fullStr Advances and Mechanisms of RNA–Ligand Interaction Predictions
title_full_unstemmed Advances and Mechanisms of RNA–Ligand Interaction Predictions
title_short Advances and Mechanisms of RNA–Ligand Interaction Predictions
title_sort advances and mechanisms of rna ligand interaction predictions
topic RNA secondary structure motifs
RNA pocket geometric feature
RNA–ligand interaction mechanism
structure prediction
url https://www.mdpi.com/2075-1729/15/1/104
work_keys_str_mv AT chenzhuo advancesandmechanismsofrnaligandinteractionpredictions
AT chengweizeng advancesandmechanismsofrnaligandinteractionpredictions
AT haoquanliu advancesandmechanismsofrnaligandinteractionpredictions
AT huiwenwang advancesandmechanismsofrnaligandinteractionpredictions
AT yunhuipeng advancesandmechanismsofrnaligandinteractionpredictions
AT yunjiezhao advancesandmechanismsofrnaligandinteractionpredictions