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6MAW
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BU of 6maw by Molmil
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
Descriptor: Fimbrial adhesin FmlD, N-[2'-{[2-(acetylamino)-2-deoxy-beta-D-galactopyranosyl]oxy}-6'-(trifluoromethyl)[1,1'-biphenyl]-3-yl]methanesulfonamide
Authors:Klein, R.D, Hultgren, S.J.
Deposit date:2018-08-28
Release date:2019-09-04
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.75 Å)
Cite:Biphenyl Gal and GalNAc FmlH Lectin Antagonists of Uropathogenic E. coli (UPEC): Optimization through Iterative Rational Drug Design.
J.Med.Chem., 62, 2019
5VQ5
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BU of 5vq5 by Molmil
Crystal Structure of the Lectin Domain From the F17-like Adhesin, UclD
Descriptor: Adhesin, IODIDE ION
Authors:Klein, R.D, Spaulding, C.N, Dodson, K.W, Pinkner, J.S, Hultgren, S.J, Fremont, D.
Deposit date:2017-05-08
Release date:2017-05-24
Last modified:2024-10-09
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Selective depletion of uropathogenic E. coli from the gut by a FimH antagonist.
Nature, 546, 2017
3UAO
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BU of 3uao by Molmil
Structure and Catalytic Mechanism of the Vitamin B3 Degradative Enzyme Maleamate Amidohydrolase from Bordetalla bronchiseptica RB50
Descriptor: ACETATE ION, Putative isochorismatase
Authors:Kincaid, V.A, Sullivan, E.D, Klein, R.D, Rowlett, R.S, Snider, M.J.
Deposit date:2011-10-21
Release date:2012-01-18
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (2.399 Å)
Cite:Structure and Catalytic Mechanism of Nicotinate (Vitamin B(3)) Degradative Enzyme Maleamate Amidohydrolase from Bordetella bronchiseptica RB50.
Biochemistry, 51, 2012
6MAP
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BU of 6map by Molmil
F9 Pilus Adhesin FmlH Lectin Domain from E. coli UTI89 in Complex with Galactoside 5-nitro-2'-{[(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-[1,1'-biphenyl]-3-carboxylic acid
Descriptor: 2'-(beta-D-galactopyranosyloxy)-5-nitro[1,1'-biphenyl]-3-carboxylic acid, Fimbrial adhesin FmlD, GLYCEROL, ...
Authors:Klein, R.D, Hultgren, S.J.
Deposit date:2018-08-28
Release date:2019-09-04
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.08 Å)
Cite:Biphenyl Gal and GalNAc FmlH Lectin Antagonists of Uropathogenic E. coli (UPEC): Optimization through Iterative Rational Drug Design.
J.Med.Chem., 62, 2019
6MAQ
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BU of 6maq by Molmil
F9 Pilus Adhesin FmlH Lectin Domain from E. coli UTI89 in Complex with Galactoside 2'-{[(2S,3R,4R,5R,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-nitro-[1,1'-biphenyl]-3-carboxylic acid
Descriptor: 2'-{[2-(acetylamino)-2-deoxy-beta-D-galactopyranosyl]oxy}-5-nitro[1,1'-biphenyl]-3-carboxylic acid, Fimbrial adhesin FmlD, GLYCEROL
Authors:Klein, R.D, Hultgren, S.J.
Deposit date:2018-08-28
Release date:2019-09-04
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.31 Å)
Cite:Biphenyl Gal and GalNAc FmlH Lectin Antagonists of Uropathogenic E. coli (UPEC): Optimization through Iterative Rational Drug Design.
J.Med.Chem., 62, 2019
5F3F
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BU of 5f3f by Molmil
Crystal structure of para-biphenyl-2-methyl-3'-methyl amide mannoside bound to FimH lectin domain
Descriptor: 3-[4-[(2~{R},3~{S},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-3-methyl-phenyl]-~{N}-methyl-benzamide, Protein FimH
Authors:Klein, R.D, Hultgren, S.J.
Deposit date:2015-12-02
Release date:2016-12-07
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.76 Å)
Cite:Antivirulence C-Mannosides as Antibiotic-Sparing, Oral Therapeutics for Urinary Tract Infections.
J.Med.Chem., 59, 2016
5NWP
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BU of 5nwp by Molmil
Crystal Structure of the Lectin Domain From the F17-like Adhesin, UclD
Descriptor: Adhesin, SULFATE ION
Authors:Ruer, S, Remaut, H.
Deposit date:2017-05-08
Release date:2017-06-21
Last modified:2024-05-01
Method:X-RAY DIFFRACTION (1.05 Å)
Cite:Selective depletion of uropathogenic E. coli from the gut by a FimH antagonist.
Nature, 546, 2017

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数据于2024-10-30公开中

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