SMTL ID : 4av4.1

FimH lectin domain co-crystal with a alpha-D-mannoside O-linked to a propynyl pyridine

Coordinates

PDB Format

Method

X-RAY DIFFRACTION 1.90 Å

Oligo State

monomer

Ligands

1 x FVQ: 3-(pyridin-3-yl)prop-2-yn-1-yl alpha-D-mannopyranoside(Non-covalent)

FVQ.1: 13 residues within 4Å: Chain A: F.1, I.13, G.14, N.46, D.47, Y.48, I.52, D.54, Q.133, N.135, Y.137, D.140, F.142 13 PLIP interactions: 13 interactions with chain A Hydrophobic interactions: A:Y.48, A:Y.48 Hydrogen bonds: A:F.1, A:N.46, A:D.47, A:Y.48, A:D.54, A:Q.133, A:N.135, A:Y.137, A:D.140 Water bridges: A:F.1, A:G.14

Links

RCSB   PDBe   PDBj   PDBsum   CATH   PLIP

Citation

Wellens, A. et al., The Tyrosine Gate as a Potential Entropic Lever in the Receptor-Binding Site of the Bacterial Adhesin Fimh. Biochemistry (2012)

Release Date

2012-06-27

Peptides

FIMH: A

SMTL:PDB

SMTL Chain Id:
PDB Chain Id:

A
A

FIMH