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iAlign

Proteins usually do not act alone. From macromolecular machinery to antibody/antigen complexes, protein-protein interactions play an essential role in a living cell. How do proteins interact with each other? High resolution structures of protein-protein complexes provide valuable insights into the mechanisms of protein-protein interactions. Structural comparison of protein-protein interfaces further facilitates studies of protein-protein interaction modes and helps to infer relationship between proteins. iAlign is a program designed for the comparison of the structures of protein-protein interfaces.

Details of the program can be found in the following references:

  • Mu Gao and Jeffrey Skolnick, 2010. iAlign: a method for the structural comparison of protein-protein interfaces. Bioinformatics, 26(18):2259-65. PDF and Supplementary Material.
  • Mu Gao and Jeffrey Skolnick, 2010. Structural space of protein-protein interfaces is degenerate, close to complete, and highly connected. PNAS 107(52):22517-22. PDF and Supplementary Material.

If you are looking for a tool for evaluating protein-protein docking models, check out IS-score.

This software is freely available to ALL users.

Download Software

You may install and run iAlign locally.

  • Linux 64 bit (version 1.1)
  • Linux 32 bit (version 1.0)

 Benchmark Datasets

  • All benchmark datasets

This page is maintained by Mu Gao. Last updated 04/01/2014.

  • Skolnick Research Group
    • Jeffrey Skolnick
    • Maximilian Brogi
    • Brendon Cara
    • Chad Choudhry
    • Brice Edelman
    • Jonathan Feldman
    • Jessica Gilmore Forness
    • Bartosz Ilkowski
    • Preetam Jukalkar
    • Giselle McPhilliamy
    • Asha Mira Rao
    • Hargobind Singh
    • Kyle Xu
    • Hongyi Zhou
    • Former Group Members
  • Software and Services
    • Services
      • DESTINI
      • DR. PRODIS
      • ENTPRISE
      • ENTPRISE-X
      • FINDSITEcomb
      • FINDSITEcomb2.0
      • FRAGSITE
      • FRAGSITE2
      • FRAGSITEcombM
      • Know-GENE
      • LeMeDISCO
      • MEDICASCY
      • MOATAI-VIR
      • PHEVIR
      • PICMOA
    • Downloads
      • AF2Complex
      • AF3Complex
      • APoc
      • Cavitator
      • DBD-Hunter
      • DBD-Threader
      • EFICAz2.5
      • Fr-TM-align
      • GOAP
      • iAlign
      • IS-score
      • LIGSIFT
      • MENDELSEEK
      • PULCHRA
      • SAdLSA
      • Valsci
    • Databases
      • Apo and Holo Pairs
      • New Human GPCR Modeling and Virtual Screening
      • PDB-like Structures
    • Simulations
      • E. coli Intracellular Dynamics

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