4CST

Crystal structure of FimH in complex with 3'-Chloro-4'-(alpha-D-mannopyranosyloxy)-biphenyl-4-carbonitrile

Summary for 4CST

• Entry DOI: 10.2210/pdb4cst/pdb
• Related: 4CSS 4CSY
• Descriptor: PROTEIN FIMH, 3'-chloro-4'-(alpha-D-mannopyranosyloxy)biphenyl-4-carbonitrile (3 entities in total)
• Functional Keywords: sugar binding protein, fimh antagonists, type i pili, uti, upec, adhesin
• Biological source: ESCHERICHIA COLI K-12
• Total number of polymer chains: 1
• Total formula weight: 17832.28

Authors

Kleeb, S.,Pang, L.,Mayer, K.,Sigl, A.,Eris, D.,Preston, R.C.,Zihlmann, P.,Abgottspon, D.,Hutter, A.,Scharenberg, M.,Jian, X.,Navarra, G.,Rabbani, S.,Smiesko, M.,Luedin, N.,Jakob, R.P.,Schwardt, O.,Maier, T.,Sharpe, T.,Ernst, B. (deposition date: 2014-03-10, release date: 2015-02-25, Last modification date: 2023-12-20)

• Primary citation: Ernst, B.,Kleeb, S.,Pang, L.,Mayer, K.,Eris, D.,Sigl, A.,Zihlmann, P.,Preston, R.C.,Sharpe, T.,Jakob, R.,Abgottspon, D.,Hutter, A.S.,Scharenberg, M.,Jiang, X.,Navarra, G.,Rabbani, S.,Smiesko, M.,Ludin, N.,Bezencon, J.,Schwardt, O.,Maier, T.; Fimh Antagonists: Bioisosteres to Improve the in Vitro and in Vivo Pk/Pd Profile.; J.Med.Chem., 58:2221-, 2015; PubMed: 25666045; DOI: 10.1021/JM501524Q

Experimental method

X-RAY DIFFRACTION (1.1 Å)