scPDB BO1 subset (protein ligand-binding sites)
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https://zenodo.org/record/7456076
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资源简介：
The BO1 subset of the scPDB database.
BO1 consists in 766 pairs of non-redundant binding-sites
(383 similar pairs, 383 dissimilar pairs).
BO1 was describbed in:
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Eguida, M., & Rognan, D. (2020).
A computer vision approach to align and compare protein cavities:
application to fragment-based drug design.
Journal of Medicinal Chemistry, 63(13), 7127-7142.
https://doi.org/10.1021/acs.jmedchem.0c00422
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The scPDB was recently describbed in:
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Desaphy, J., Bret, G., Rognan, D., & Kellenberger, E. (2015).
sc-PDB: a 3D-database of ligandable binding sites—10 years on.
Nucleic acids research, 43(D1), D399-D404.
https://doi.org/10.1093/nar/gku928
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The scPDB is available at:
http://bioinfo-pharma.u-strasbg.fr/scPDB/
创建时间：
2022-12-19
