6MAW
F9 Pilus Adhesin FmlH Lectin Domain from E. coli UTI89 in Complex with Galactoside N-[(2S,3R,4R,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[S-methyl-6-(trifluoromethyl)-[1,1'-biphenyl]-3'-yl]oxy}oxan-3-yl]acetamide
Summary for 6MAW
Entry DOI | 10.2210/pdb6maw/pdb |
Descriptor | Fimbrial adhesin FmlD, N-[2'-{[2-(acetylamino)-2-deoxy-beta-D-galactopyranosyl]oxy}-6'-(trifluoromethyl)[1,1'-biphenyl]-3-yl]methanesulfonamide (3 entities in total) |
Functional Keywords | pilus, adhesin, galactose, lectin, sugar binding protein, sugar binding protein-inhibitor complex, sugar binding protein/inhibitor |
Biological source | Escherichia coli UTI89 |
Total number of polymer chains | 1 |
Total formula weight | 18454.59 |
Authors | Klein, R.D.,Hultgren, S.J. (deposition date: 2018-08-28, release date: 2019-09-04, Last modification date: 2023-12-13) |
Primary citation | Maddirala, A.R.,Klein, R.,Pinkner, J.S.,Kalas, V.,Hultgren, S.J.,Janetka, J.W. Biphenyl Gal and GalNAc FmlH Lectin Antagonists of Uropathogenic E. coli (UPEC): Optimization through Iterative Rational Drug Design. J.Med.Chem., 62:467-479, 2019 Cited by PubMed: 30540910DOI: 10.1021/acs.jmedchem.8b01561 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.75 Å) |
Structure validation
Download full validation report