SMTL ID : 6as8.1 (1 other biounit)

F9 pilus adhesin FmlH lectin domain from E. coli UTI89 co-crystallized with ortho-biphenyl-2'-carboxyl N-acetyl-beta-galactosaminoside

Coordinates

PDB Format

Method

X-RAY DIFFRACTION 2.10 Å

Oligo State

monomer

Ligands

1 x BTG: ortho-biphenyl-2'-carboxyl N-acetyl-beta-galactosaminoside(Non-covalent)

BTG.1: 13 residues within 4Å: Chain A: F.1, S.2, G.12, N.44, D.45, Y.46, D.51, D.53, K.132, A.134, G.139, N.140, R.142 12 PLIP interactions: 12 interactions with chain A Hydrophobic interactions: A:D.45, A:Y.46, A:N.140 Hydrogen bonds: A:F.1, A:D.45, A:D.51, A:D.53, A:K.132, A:N.140, A:R.142 Salt bridges: A:K.132, A:R.142

Links

RCSB   PDBe   PDBj   PDBsum   CATH   PLIP

Citation

Kalas, V. et al., Structure-based discovery of glycomimetic FmlH ligands as inhibitors of bacterial adhesion during urinary tract infection. Proc.Natl.Acad.Sci.USA (2018)

Release Date

2018-02-28

Peptides

Fml fimbrial adhesin FmlD: A

SMTL:PDB

SMTL Chain Id:
PDB Chain Id:

A
A

Fml fimbrial adhesin FmlD

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