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Related Concept Videos

Protein Families02:47

Protein Families

Protein families are groups of homologous proteins; that is, they have similarities in amino acid sequences and three-dimensional structures. Protein families usually occur because of gene duplication, where an additional copy of a gene is inserted into the genome of an organism.   Mutations that change the amino acids but still allow the protein to be properly synthesized, will lead to new protein family members.   If these new proteins contain similar amino acids in key locations, protein...
Conserved Binding Sites01:49

Conserved Binding Sites

Many proteins’ biological role depends on their interactions with their ligands, small molecules that bind to specific locations on the protein known as ligand-binding sites. Ligand-binding sites are often conserved among homologous proteins as these sites are critical for protein function.
Binding sites are often located in large pockets, and if their location on a protein’s surface is unknown, it can be predicted using various approaches. The energetic method computationally analyses the...
Evolutionary Relationships through Genome Comparisons02:54

Evolutionary Relationships through Genome Comparisons

Genome comparison is one of the excellent ways to interpret the evolutionary relationships between organisms. The basic principle of genome comparison is that if two species share a common feature, it is likely encoded by the DNA sequence conserved between both species. The advent of genome sequencing technologies in the late 20th century enabled scientists to understand the concept of conservation of domains between species and helped them to deduce evolutionary relationships across diverse...
Protein Organization01:24

Protein Organization

Proteins are polymers of amino acid residues. They are versatile and responsible for different cellular functions, including DNA replication, molecular transport, catalysis, and structural support. Proteins have a hierarchical structure comprising at least three levels of organization: primary, secondary, and tertiary structure. Some large proteins have a quaternary structure where individual protein subunits are linked together.
The primary structure of a protein is its amino acid sequence.
Conservation of Protein Domains Over Different Proteins02:26

Conservation of Protein Domains Over Different Proteins

Protein domains are small structurally independent units that are part of a single amino acid chain.  Although these domains are often structurally independent, they may rely on synergistic effects to perform their functions as part of a larger protein. Protein domains may be conserved within the same organism, as well as across different organisms.
A limited set of protein domains often duplicate and recombine during evolution. These domains can be organized in different combinations to form...
Protein-protein Interfaces02:04

Protein-protein Interfaces

Many proteins form complexes to carry out their functions, making protein-protein interactions (PPIs) essential for an organism's survival. Most PPIs are stabilized by numerous weak noncovalent chemical forces. The physical shape of the interfaces determines the way two proteins interact. Many globular proteins have closely-matching shapes on their surfaces, which form a large number of weak bonds. Additionally, many PPIs occur between two helices or between a surface cleft and a polypeptide...

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Related Experiment Video

Updated: Jul 17, 2026

A Protocol for Computer-Based Protein Structure and Function Prediction
16:41

A Protocol for Computer-Based Protein Structure and Function Prediction

Published on: November 3, 2011

Benchmarking protein sequence and structure search methods for remote homology detection.

Yuan Liu1, Yingquan Zhou1, Yan Huang2

  • 1Institute of Image Processing and Pattern Recognition, Shanghai Jiao Tong University, and Key Laboratory of System Control and Information Processing, Ministry of Education of China, Shanghai, 200240, China.

Genome Biology
|July 16, 2026
PubMed
Summary

A new benchmark evaluates protein similarity search methods. Representation-based methods show promise for functional similarity, while structure alignment excels at fold-level detection, highlighting context-dependent performance differences.

Keywords:
BenchmarkProtein similarity searchRepresentation-based searchingStructure alignment

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Application of I TASSER, trRosetta, UCSF Chimera, HADDOCK server, and HEX loria for De Novo and In Silico Design of Proteins
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Area of Science:

  • Bioinformatics
  • Computational Biology
  • Structural Biology

Background:

  • Protein sequence and structure similarity searches are crucial for annotation, evolutionary analysis, and functional inference.
  • Existing evaluation methods are limited to fold-level similarity and lack standardized protocols.
  • The growing volume of sequence and predicted structure data necessitates robust search and evaluation strategies.

Purpose of the Study:

  • To establish a comprehensive benchmark for evaluating protein sequence and structure similarity search methods.
  • To compare the performance of diverse search approaches across various biological contexts.
  • To provide a standardized framework for assessing homology search tools.

Main Methods:

  • Development of a comprehensive benchmark framework for protein similarity search.
  • Evaluation of 14 representative methods including sequence alignment, structure alignment, and representation-based approaches.
  • Testing across multiple biologically relevant scenarios to assess performance variations.

Main Results:

  • Significant, context-dependent performance differences were observed among evaluated methods.
  • Structure alignment methods effectively detect fold-level and geometric similarity.
  • Representation-based methods demonstrate strengths in functional similarity detection, especially with low sequence identity and predicted structures.
  • Intrinsically disordered proteins presented a challenge for all tested methods.

Conclusions:

  • The developed benchmark provides a standardized framework for evaluating protein similarity search methods.
  • This resource aids in selecting appropriate methods for specific homology search tasks.
  • It lays the groundwork for developing next-generation search approaches to address complex homology challenges.