Mofan Feng, Liangjie Liu, Zhuo-Ning Xian, Xiaoxi Wei, Keyi Li, Wenqian Yan, Qing Lu, Yi Shi, Guang He
{"title":"PSTP:使用蛋白质构象和语言模型嵌入的精确残差级相分离预测。","authors":"Mofan Feng, Liangjie Liu, Zhuo-Ning Xian, Xiaoxi Wei, Keyi Li, Wenqian Yan, Qing Lu, Yi Shi, Guang He","doi":"10.1093/bib/bbaf171","DOIUrl":null,"url":null,"abstract":"<p><p>Phase separation (PS) is essential in cellular processes and disease mechanisms, highlighting the need for predictive algorithms to analyze uncharacterized sequences and accelerate experimental validation. Current high-accuracy methods often rely on extensive annotations or handcrafted features, limiting their generalizability to sequences lacking such annotations and making it difficult to identify key protein regions involved in PS. We introduce Phase Separation's Transfer-learning Prediction (PSTP), which combines conformational embeddings with large language model embeddings, enabling state-of-the-art PS predictions from protein sequences alone. PSTP performs well across various prediction scenarios and shows potential for predicting novel-designed artificial proteins. Additionally, PSTP provides residue-level predictions that are highly correlated with experimentally validated PS regions. By analyzing 160 000+ variants, PSTP characterizes the strong link between the incidence of pathogenic variants and residue-level PS propensities in unconserved intrinsically disordered regions, offering insights into underexplored mutation effects. PSTP's sliding-window optimization reduces its memory usage to a few hundred megabytes, facilitating rapid execution on typical CPUs and GPUs. Offered via both a web server and an installable Python package, PSTP provides a versatile tool for decoding protein PS behavior and supporting disease-focused research.</p>","PeriodicalId":9209,"journal":{"name":"Briefings in bioinformatics","volume":"26 3","pages":""},"PeriodicalIF":6.8000,"publicationDate":"2025-05-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC12047702/pdf/","citationCount":"0","resultStr":"{\"title\":\"PSTP: accurate residue-level phase separation prediction using protein conformational and language model embeddings.\",\"authors\":\"Mofan Feng, Liangjie Liu, Zhuo-Ning Xian, Xiaoxi Wei, Keyi Li, Wenqian Yan, Qing Lu, Yi Shi, Guang He\",\"doi\":\"10.1093/bib/bbaf171\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<p><p>Phase separation (PS) is essential in cellular processes and disease mechanisms, highlighting the need for predictive algorithms to analyze uncharacterized sequences and accelerate experimental validation. Current high-accuracy methods often rely on extensive annotations or handcrafted features, limiting their generalizability to sequences lacking such annotations and making it difficult to identify key protein regions involved in PS. We introduce Phase Separation's Transfer-learning Prediction (PSTP), which combines conformational embeddings with large language model embeddings, enabling state-of-the-art PS predictions from protein sequences alone. PSTP performs well across various prediction scenarios and shows potential for predicting novel-designed artificial proteins. Additionally, PSTP provides residue-level predictions that are highly correlated with experimentally validated PS regions. By analyzing 160 000+ variants, PSTP characterizes the strong link between the incidence of pathogenic variants and residue-level PS propensities in unconserved intrinsically disordered regions, offering insights into underexplored mutation effects. PSTP's sliding-window optimization reduces its memory usage to a few hundred megabytes, facilitating rapid execution on typical CPUs and GPUs. Offered via both a web server and an installable Python package, PSTP provides a versatile tool for decoding protein PS behavior and supporting disease-focused research.</p>\",\"PeriodicalId\":9209,\"journal\":{\"name\":\"Briefings in bioinformatics\",\"volume\":\"26 3\",\"pages\":\"\"},\"PeriodicalIF\":6.8000,\"publicationDate\":\"2025-05-01\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC12047702/pdf/\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Briefings in bioinformatics\",\"FirstCategoryId\":\"99\",\"ListUrlMain\":\"https://doi.org/10.1093/bib/bbaf171\",\"RegionNum\":2,\"RegionCategory\":\"生物学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"BIOCHEMICAL RESEARCH METHODS\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Briefings in bioinformatics","FirstCategoryId":"99","ListUrlMain":"https://doi.org/10.1093/bib/bbaf171","RegionNum":2,"RegionCategory":"生物学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"BIOCHEMICAL RESEARCH METHODS","Score":null,"Total":0}
PSTP: accurate residue-level phase separation prediction using protein conformational and language model embeddings.
Phase separation (PS) is essential in cellular processes and disease mechanisms, highlighting the need for predictive algorithms to analyze uncharacterized sequences and accelerate experimental validation. Current high-accuracy methods often rely on extensive annotations or handcrafted features, limiting their generalizability to sequences lacking such annotations and making it difficult to identify key protein regions involved in PS. We introduce Phase Separation's Transfer-learning Prediction (PSTP), which combines conformational embeddings with large language model embeddings, enabling state-of-the-art PS predictions from protein sequences alone. PSTP performs well across various prediction scenarios and shows potential for predicting novel-designed artificial proteins. Additionally, PSTP provides residue-level predictions that are highly correlated with experimentally validated PS regions. By analyzing 160 000+ variants, PSTP characterizes the strong link between the incidence of pathogenic variants and residue-level PS propensities in unconserved intrinsically disordered regions, offering insights into underexplored mutation effects. PSTP's sliding-window optimization reduces its memory usage to a few hundred megabytes, facilitating rapid execution on typical CPUs and GPUs. Offered via both a web server and an installable Python package, PSTP provides a versatile tool for decoding protein PS behavior and supporting disease-focused research.
期刊介绍:
Briefings in Bioinformatics is an international journal serving as a platform for researchers and educators in the life sciences. It also appeals to mathematicians, statisticians, and computer scientists applying their expertise to biological challenges. The journal focuses on reviews tailored for users of databases and analytical tools in contemporary genetics, molecular and systems biology. It stands out by offering practical assistance and guidance to non-specialists in computerized methodologies. Covering a wide range from introductory concepts to specific protocols and analyses, the papers address bacterial, plant, fungal, animal, and human data.
The journal's detailed subject areas include genetic studies of phenotypes and genotypes, mapping, DNA sequencing, expression profiling, gene expression studies, microarrays, alignment methods, protein profiles and HMMs, lipids, metabolic and signaling pathways, structure determination and function prediction, phylogenetic studies, and education and training.