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PDBsum entry 1w8h

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protein ligands metals Protein-protein interface(s) links
Sugar binding protein PDB id
1w8h

 

 

 

 

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Contents
Protein chains
114 a.a. *
Ligands
NAG-GAL-NDG-FUC
NAG-NDG-GAL-FUC ×2
NDG-NAG-GAL-FUC
SO4 ×2
GOL ×3
Metals
_CA ×8
Waters ×438
* Residue conservation analysis
PDB id:
1w8h
Name: Sugar binding protein
Title: Structure of pseudomonas aeruginosa lectin ii (pa-iil)complexed with lewisa trisaccharide
Structure: Pseudomonas aeruginosa lectin ii. Chain: a, b, c, d. Synonym: pa-iil. Engineered: yes. Other_details: each monomer contains two close calcium cations that mediate the binding of the saccharide
Source: Pseudomonas aeruginosa. Organism_taxid: 287. Expressed in: escherichia coli. Expression_system_taxid: 469008.
Biol. unit: Tetramer (from PDB file)
Resolution:
1.75Å     R-factor:   0.126     R-free:   0.169
Authors: S.Perret,C.Sabin,C.Dumon,M.Budova,C.Gautier,O.Galanina,S.Ilia, N.Bovin,M.Nicaise,M.Desmadril,N.Gilboa-Garber,M.Wimmerova, E.P.Mitchell,A.Imberty
Key ref: S.Perret et al. (2005). Structural basis for the interaction between human milk oligosaccharides and the bacterial lectin PA-IIL of Pseudomonas aeruginosa. Biochem J, 389, 325-332. PubMed id: 15790314
Date:
21-Sep-04     Release date:   31-Mar-05    
PROCHECK
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 Headers
 References

Protein chains
Pfam   ArchSchema ?
Q9HYN5  (Q9HYN5_PSEAE) -  Fucose-binding lectin PA-IIL from Pseudomonas aeruginosa (strain ATCC 15692 / DSM 22644 / CIP 104116 / JCM 14847 / LMG 12228 / 1C / PRS 101 / PAO1)
Seq:
Struc:
115 a.a.
114 a.a.
Key:    PfamA domain  Secondary structure  CATH domain

 Enzyme reactions 
   Enzyme class: E.C.?
[IntEnz]   [ExPASy]   [KEGG]   [BRENDA]

 

 
Biochem J 389:325-332 (2005)
PubMed id: 15790314  
 
 
Structural basis for the interaction between human milk oligosaccharides and the bacterial lectin PA-IIL of Pseudomonas aeruginosa.
S.Perret, C.Sabin, C.Dumon, M.Pokorná, C.Gautier, O.Galanina, S.Ilia, N.Bovin, M.Nicaise, M.Desmadril, N.Gilboa-Garber, M.Wimmerová, E.P.Mitchell, A.Imberty.
 
  ABSTRACT  
 
One of the mechanisms contributing to the protection by breast-feeding of the newborn against enteric diseases is related to the ability of human milk oligosaccharides to prevent the attachment of pathogenic bacteria to the duodenual epithelium. Indeed, a variety of fucosylated oligosaccharides, specific to human milk, form part of the innate immune system. In the present study, we demonstrate the specific blocking of PA-IIL, a fucose-binding lectin of the human pathogen Pseudomonas aeruginosa, by milk oligosaccharides. Two fucosylated epitopes, Lewis a and 3-fucosyl-lactose (Lewis x glucose analogue) bind to the lectin with dissociation constants of 2.2x10(-7) M and 3.6x10(-7) M respectively. Thermodynamic studies indicate that these interactions are dominated by enthalpy. The entropy contribution is slightly favourable when binding to fucose and to the highest-affinity ligand, Lewis a. The high-resolution X-ray structures of two complexes of PA-IIL with milk oligosaccharides allow the precise determination of the conformation of a trisaccharide and a pentasaccharide. The different types of interaction between the oligosaccharides and the protein involve not only hydrogen bonding, but also calcium- and water-bridged contacts, allowing a rationalization of the thermodynamic data. This study provides important structural information about compounds that could be of general application in new therapeutic strategies against bacterial infections.
 

Literature references that cite this PDB file's key reference

  PubMed id Reference
19629075 B.Ernst, and J.L.Magnani (2009).
From carbohydrate leads to glycomimetic drugs.
  Nat Rev Drug Discov, 8, 661-677.  
19237519 C.Chemani, A.Imberty, S.de Bentzmann, M.Pierre, M.Wimmerová, B.P.Guery, and K.Faure (2009).
Role of LecA and LecB lectins in Pseudomonas aeruginosa-induced lung injury and effect of carbohydrate ligands.
  Infect Immun, 77, 2065-2075.  
18043624 B.Lerrer, K.D.Zinger-Yosovich, B.Avrahami, and N.Gilboa-Garber (2007).
Honey and royal jelly, like human milk, abrogate lectin-dependent infection-preceding Pseudomonas aeruginosa adhesion.
  ISME J, 1, 149-155.  
17420244 H.Feinberg, M.E.Taylor, and W.I.Weis (2007).
Scavenger receptor C-type lectin binds to the leukocyte cell surface glycan Lewis(x) by a novel mechanism.
  J Biol Chem, 282, 17250-17258.
PDB codes: 2ox8 2ox9
17540045 J.Adam, M.Pokorná, C.Sabin, E.P.Mitchell, A.Imberty, and M.Wimmerová (2007).
Engineering of PA-IIL lectin from Pseudomonas aeruginosa - Unravelling the role of the specificity loop for sugar preference.
  BMC Struct Biol, 7, 36.
PDB codes: 2jdm 2jdn 2jdp 2jdu 2jdy
17728861 K.Marotte, C.Préville, C.Sabin, M.Moumé-Pymbock, A.Imberty, and R.Roy (2007).
Synthesis and binding properties of divalent and trivalent clusters of the Lewis a disaccharide moiety to Pseudomonas aeruginosa lectin PA-IIL.
  Org Biomol Chem, 5, 2953-2961.  
17623286 K.Marotte, C.Sabin, C.Préville, M.Moumé-Pymbock, M.Wimmerová, E.P.Mitchell, A.Imberty, and R.Roy (2007).
X-ray Structures and Thermodynamics of the Interaction of PA-IIL from Pseudomonas aeruginosa with Disaccharide Derivatives.
  ChemMedChem, 2, 1328-1338.
PDB codes: 2jdh 2jdk
The most recent references are shown first. Citation data come partly from CiteXplore and partly from an automated harvesting procedure. Note that this is likely to be only a partial list as not all journals are covered by either method. However, we are continually building up the citation data so more and more references will be included with time. Where a reference describes a PDB structure, the PDB codes are shown on the right.

 

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