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=How can I calculate a structure alignment?=
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=== What is a structure alignment? ===
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'''Structural alignment''' attempts to establish equivalences between two or more polymer structures based on their shape and three-dimensional conformation. 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 imply evolutionary relationships between proteins that share very little common sequence. However, caution should be used in using the results as evidence for shared evolutionary ancestry because of the possible confounding effects of convergent evolution by which multiple unrelated amino acid sequences converge on a common tertiary structure.
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'''Structural alignment''' attempts to establish equivalences between two or more polymer structures based on their shape and three-dimensional conformation. In contrast to simple structural superposition (see below), 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 imply evolutionary relationships between proteins that share very little common sequence. However, caution should be used in using the results as evidence for shared evolutionary ancestry because of the possible confounding effects of convergent evolution by which multiple unrelated amino acid sequences converge on a common tertiary structure.
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For more info see the [http://en.wikipedia.org/wiki/Structural_alignment Wikipedia article on protein structure alignment].
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=== Alignment with Cobinatorial Extension (CE) and FATCAT ===
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The structure alignment possibilities of BioJava are going to be greatly enhanced in the upcoming BioJava 3 release. It provides a BioJava port of the '''Combinatorial Extension''' algorithm (CE) as well as of the '''FATCAT''' algorithm. The documentation how to use this algorithm is available from
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