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PDBsum entry 2g7c

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Toxin PDB id
2g7c
Contents
Protein chains
245 a.a.
Ligands
NAG-GAL-GLA ×4
GOL ×6
Waters ×413

References listed in PDB file
Key reference
Title Carbohydrate recognition by clostridium difficile toxin a.
Authors A.Greco, J.G.Ho, S.J.Lin, M.M.Palcic, M.Rupnik, K.K.Ng.
Ref. Nat Struct Mol Biol, 2006, 13, 460-461. [DOI no: 10.1038/nsmb1084]
PubMed id 16622409
Abstract
Clostridium difficile TcdA is a large toxin that binds carbohydrates on intestinal epithelial cells. A 2-A resolution cocrystal structure reveals two molecules of alpha-Gal-(1,3)-beta-Gal-(1,4)-beta-GlcNAcO(CH(2))(8)CO(2)CH(3) binding in an extended conformation to TcdA. Residues forming key contacts with the trisaccharides are conserved in all seven putative binding sites in TcdA, suggesting a mode of multivalent binding that may be exploited for the rational design of novel therapeutics.
Figure 1.
Figure 1. Structure of TcdA-f2. (a) Ribbon structure and schematic with SRs (dark blue), SR3 and SR6 (cyan), and LRs (green) highlighted. (b) Ribbon representation of TcdA-f2 and bound trisaccharides, viewed from the N terminus. The reducing-end -GlcNAc is colored yellow.
Figure 2.
Figure 2. TcdA-f2 bound to CD-grease at BS1A. Hydrogen bonds are drawn as dashed lines.
The above figures are reprinted by permission from Macmillan Publishers Ltd: Nat Struct Mol Biol (2006, 13, 460-461) copyright 2006.
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 Headers

 

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