SMTL ID : 4x5q.1

Crystal structure of FimH in complex with 5-nitro-indolinylphenyl alpha-D-mannopyranoside

Coordinates

PDB Format

Method

X-RAY DIFFRACTION 1.12 Å

Oligo State

monomer

Ligands

1 x 3XN: 4-(5-nitro-1H-indol-1-yl)phenyl alpha-D-mannopyranoside(Non-covalent)

3XN.1: 15 residues within 4Å: Chain A: F.1, I.13, G.14, N.46, D.47, Y.48, T.51, I.52, D.54, Q.133, N.135, Y.137, N.138, D.140, F.142 16 PLIP interactions: 16 interactions with chain A Hydrophobic interactions: A:Y.48, A:I.52 Hydrogen bonds: A:F.1, A:D.47, A:Y.48, A:D.54, A:D.54, A:Q.133, A:N.135, A:D.140, A:D.140 Water bridges: A:F.1, A:Q.133, A:N.138 pi-Stacking: A:Y.48, A:Y.48

Links

RCSB   PDBe   PDBj   PDBsum   CATH   PLIP

Citation

Fiege, B. et al., The Tyrosine Gate of the Bacterial Lectin FimH: A Conformational Analysis by NMR Spectroscopy and X-ray Crystallography. Chembiochem (2015)

Release Date

2015-05-20

Peptides

Protein FimH: A

SMTL:PDB

SMTL Chain Id:
PDB Chain Id:

A
A

Protein FimH

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