4X5R

Crystal structure of FimH in complex with a squaryl-phenyl alpha-D-mannopyranoside derivative

Summary for 4X5R

• Entry DOI: 10.2210/pdb4x5r/pdb
• Related: 4CSS 4CST
• Descriptor: Protein FimH, 2-chloro-4-{[2-(4-methylpiperazin-1-yl)-3,4-dioxocyclobut-1-en-1-yl]amino}phenyl alpha-D-mannopyranoside, SULFATE ION, ... (4 entities in total)
• Functional Keywords: sugar binding protein, bacterial adhesin, pilus, upec, antagonist complex, cell adhesion
• Biological source: Escherichia coli K-12
• Cellular location: Fimbrium: P08191
• Total number of polymer chains: 3
• Total formula weight: 52808.88

Authors

Preston, R.C.,Jakob, R.P.,Fiege, B.,Zihlmann, P.,Rabbani, S.,Schwardt, O.,Jiang, X.,Ernst, B.,Maier, T. (deposition date: 2014-12-05, release date: 2015-05-20, Last modification date: 2024-01-10)

• Primary citation: Fiege, B.,Rabbani, S.,Preston, R.C.,Jakob, R.P.,Zihlmann, P.,Schwardt, O.,Jiang, X.,Maier, T.,Ernst, B.; The Tyrosine Gate of the Bacterial Lectin FimH: A Conformational Analysis by NMR Spectroscopy and X-ray Crystallography.; Chembiochem, 16:1235-1246, 2015; PubMed: 25940742; DOI: 10.1002/cbic.201402714

Experimental method

X-RAY DIFFRACTION (1.65 Å)