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Everything about Structural alignment

Aligning molecular sequences using sequence and structural information

Structural alignment attempts to establish homology between two or more polymer structures based on their shape and three-dimensional conformation. This process is usually applied to protein tertiary structures but can also be used for large RNA molecules. In contrast to simple structural superposition, where at least some equivalent residues of the two structures are known, structural alignment requires no a priori knowledge of equivalent positions. Structural alignment is a valuable tool for the comparison of proteins with low sequence similarity, where evolutionary relationships between proteins cannot be easily detected by standard sequence alignment techniques. Structural alignment can therefore be used to infer evolutionary relationships between proteins that share very little common sequence. Those relationships can then be characterized through structural phylogenetics. However, caution should be taken when interpreting any results as evidence for shared evolutionary ancestry due to the potential confounding effects of convergent evolution, by which unrelated or distantly-related amino acid sequences converge on a common tertiary structure. Wikipedia →

🧭 Start here: a 6-step reading path

  1. Read the overview: Structural alignmentA 5-minute orientation
  2. Skim a recent paper: Broadband convolutional processing using band-alignment-tunable heterostructuresInfluential work since 2022
  3. Pick up a classic book: Introduction to Protein ArchitectureThe most-reprinted book on the subject
  4. Read the landmark paper: MUSTANG: A multiple structural alignment algorithmCited 660 times
  5. Go sideways: SuperPoseA closely related topic
  6. Go sideways: Template modeling scoreA closely related topic

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