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1APN
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BU of 1apn by Molmil
THE CRYSTALLOGRAPHIC STRUCTURE OF METAL-FREE CONCANAVALIN A AT 2.5 ANGSTROMS RESOLUTION
Descriptor: CONCANAVALIN A
Authors:Bouckaert, J, Loris, R, Poortmans, F, Wyns, L.
Deposit date:1995-07-28
Release date:1996-04-03
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Crystallographic structure of metal-free concanavalin A at 2.5 A resolution.
Proteins, 23, 1995
1TR7
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BU of 1tr7 by Molmil
FimH adhesin receptor binding domain from uropathogenic E. coli
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, CACODYLATE ION, FimH protein, ...
Authors:Bouckaert, J, Berglund, J, Schembri, M, De Genst, E, Cools, L, Wuhrer, M, Hung, C.S, Pinkner, J, Slattegard, R, Zavialov, A, Choudhury, D, Langermann, S, Hultgren, S.J, Wyns, L, Klemm, P, Oscarson, S, Knight, S.D, De Greve, H.
Deposit date:2004-06-21
Release date:2005-05-03
Last modified:2023-10-25
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Receptor binding studies disclose a novel class of high-affinity inhibitors of the Escherichia coli FimH adhesin
Mol.Microbiol., 55, 2005
1UWF
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BU of 1uwf by Molmil
1.7 A resolution structure of the receptor binding domain of the FimH adhesin from uropathogenic E. coli
Descriptor: FIMH PROTEIN, GLYCEROL, butyl alpha-D-mannopyranoside
Authors:Bouckaert, J, Berglund, J, Genst, E.D, Cools, L, Hung, C.-S, Wuhrer, M, Zavialov, A, Langermann, S, Hultgren, S, Wyns, L, Oscarson, S, Knight, S.D, De Greve, H.
Deposit date:2004-02-05
Release date:2005-02-16
Last modified:2023-12-13
Method:X-RAY DIFFRACTION (1.69 Å)
Cite:Receptor Binding Studies Disclose a Novel Class of High-Affinity Inhibitors of the Escherichia Coli Fimh Adhesin.
Mol.Microbiol., 55, 2005
2ENR
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BU of 2enr by Molmil
CO-CRYSTALS OF DEMETALLIZED CONCANAVALIN A WITH CADMIUM HAVING A CADMIUM ION BOUND IN BOTH THE S1 SITE AND THE S2 SITE
Descriptor: CADMIUM ION, CONCANAVALIN A
Authors:Bouckaert, J, Loris, R, Wyns, L.
Deposit date:1998-07-14
Release date:1999-02-16
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:Zinc/calcium- and cadmium/cadmium-substituted concanavalin A: interplay of metal binding, pH and molecular packing.
Acta Crystallogr.,Sect.D, 56, 2000
1CES
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BU of 1ces by Molmil
CRYSTALS OF DEMETALLIZED CONCANAVALIN A SOAKED WITH ZINC HAVE A ZINC ION BOUND IN THE S1 SITE
Descriptor: CONCANAVALIN A, ZINC ION
Authors:Bouckaert, J, Loris, R, Poortmans, F, Wyns, L.
Deposit date:1996-02-15
Release date:1997-02-15
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:Sequential structural changes upon zinc and calcium binding to metal-free concanavalin A.
J.Biol.Chem., 271, 1996
1ENS
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BU of 1ens by Molmil
CRYSTALS OF DEMETALLIZED CONCANAVALIN A SOAKED WITH COBALT HAVING A COBALT ION BOUND IN THE S1 SITE
Descriptor: COBALT (II) ION, CONCANAVALIN A
Authors:Bouckaert, J, Loris, R, Poortmans, F, Wyns, L.
Deposit date:1996-03-20
Release date:1996-08-17
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:Sequential structural changes upon zinc and calcium binding to metal-free concanavalin A.
J.Biol.Chem., 271, 1996
1ENR
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BU of 1enr by Molmil
CO-CRYSTALS OF DEMETALLIZED CONCANAVALIN A WITH ZINC AND CALCIUM HAVING A ZINC ION BOUND IN THE S1 SITE AND A CALCIUM ION BOUND IN THE S2 SITE
Descriptor: CALCIUM ION, CONCANAVALIN A, ZINC ION
Authors:Bouckaert, J, Loris, R, Poortmans, F, Wyns, L.
Deposit date:1996-03-20
Release date:1996-08-17
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.83 Å)
Cite:Sequential structural changes upon zinc and calcium binding to metal-free concanavalin A.
J.Biol.Chem., 271, 1996
1ENQ
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BU of 1enq by Molmil
CO-CRYSTALS OF DEMETALLIZED CONCANAVALIN A WITH ZINC HAVING A ZINC ION BOUND IN THE S1 SITE
Descriptor: CONCANAVALIN A, ZINC ION
Authors:Bouckaert, J, Loris, R, Poortmans, F, Wyns, L.
Deposit date:1996-03-20
Release date:1996-08-17
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Sequential structural changes upon zinc and calcium binding to metal-free concanavalin A.
J.Biol.Chem., 271, 1996
3ENR
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BU of 3enr by Molmil
ZINC-CALCIUM CONCANAVALIN A AT PH 6.15
Descriptor: CALCIUM ION, Concanavalin-A, ZINC ION
Authors:Bouckaert, J, Loris, R, Wyns, L.
Deposit date:1999-02-11
Release date:2000-09-18
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Zinc/calcium- and cadmium/cadmium-substituted concanavalin A: interplay of metal binding, pH and molecular packing.
Acta Crystallogr.,Sect.D, 56, 2000
1DQ0
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BU of 1dq0 by Molmil
Locked, metal-free concanavalin A, a minor species in solution
Descriptor: Concanavalin-Br
Authors:Bouckaert, J, Dewallef, Y, Poortmans, F, Wyns, L, Loris, R.
Deposit date:1999-12-29
Release date:2000-01-19
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:The structural features of concanavalin A governing non-proline peptide isomerization
J.Biol.Chem., 275, 2000
1QDC
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BU of 1qdc by Molmil
MAN(APLHA1-6)MAN(ALPHA1-O)METHYL CONCANAVALIN A COMPLEX
Descriptor: CALCIUM ION, CHLORIDE ION, MANGANESE (II) ION, ...
Authors:Bouckaert, J, Loris, R, Wyns, L.
Deposit date:1998-07-14
Release date:1999-10-14
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2 Å)
Cite:The crystal structures of Man(alpha1-3)Man(alpha1-O)Me and Man(alpha1-6)Man(alpha1-O)Me in complex with concanavalin A.
J.Biol.Chem., 274, 1999
1QDO
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BU of 1qdo by Molmil
MAN(APLHA1-3)MAN(ALPHA1-O)METHYL CONCANAVALIN A COMPLEX
Descriptor: CALCIUM ION, MANGANESE (II) ION, PROTEIN (CONCANAVALIN A), ...
Authors:Bouckaert, J, Loris, R, Wyns, L.
Deposit date:1999-05-24
Release date:1999-10-14
Last modified:2023-08-16
Method:X-RAY DIFFRACTION (2.8 Å)
Cite:The crystal structures of Man(alpha1-3)Man(alpha1-O)Me and Man(alpha1-6)Man(alpha1-O)Me in complex with concanavalin A.
J.Biol.Chem., 274, 1999
1DQ5
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BU of 1dq5 by Molmil
Manganese;Manganese concanavalin A at pH 5.0
Descriptor: Concanavalin-Br, MANGANESE (II) ION
Authors:Bouckaert, J, Dewallef, Y, Poortmans, F, Wyns, L, Loris, R.
Deposit date:1999-12-30
Release date:2000-01-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2 Å)
Cite:The structural features of concanavalin A governing non-proline peptide isomerization
J.Biol.Chem., 275, 2000
1DQ2
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BU of 1dq2 by Molmil
Unlocked metal-free concanavalin A
Descriptor: ACETIC ACID, Concanavalin-Br
Authors:Bouckaert, J, Dewallef, Y, Poortmans, F, Wyns, L, Loris, R.
Deposit date:1999-12-29
Release date:2000-01-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.05 Å)
Cite:The structural features of concanavalin A governing non-proline peptide isomerization
J.Biol.Chem., 275, 2000
1DQ6
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BU of 1dq6 by Molmil
Manganese;Manganese concanavalin A at pH 7.0
Descriptor: Concanavalin-A, MANGANESE (II) ION
Authors:Bouckaert, J, Dewallef, Y, Poortmans, F, Wyns, L, Loris, R.
Deposit date:1999-12-30
Release date:2000-01-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The structural features of concanavalin A governing non-proline peptide isomerization
J.Biol.Chem., 275, 2000
1DQ1
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BU of 1dq1 by Molmil
Calcium;Calcium concanavalin A
Descriptor: CALCIUM ION, Concanavalin-Br
Authors:Bouckaert, J, Dewallef, Y, Poortmans, F, Wyns, L, Loris, R.
Deposit date:1999-12-29
Release date:2000-01-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.15 Å)
Cite:The structural features of concanavalin A governing non-proline peptide isomerization
J.Biol.Chem., 275, 2000
1DQ4
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BU of 1dq4 by Molmil
A transient unlocked concanavalin A structure with MN2+ bound in the transition metal ion binding site S1 and an empty calcium binding site S2
Descriptor: Concanavalin-Br, MANGANESE (II) ION
Authors:Bouckaert, J, Dewallef, Y, Poortmans, F, Wyns, L, Loris, R.
Deposit date:1999-12-30
Release date:2000-01-19
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:The structural features of concanavalin A governing non-proline peptide isomerization
J.Biol.Chem., 275, 2000
7QUO
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BU of 7quo by Molmil
FimH lectin domain in complex with oligomannose-6
Descriptor: FimH, NICKEL (II) ION, SULFATE ION, ...
Authors:Bouckaert, J, Bourenkov, G.P.
Deposit date:2022-01-18
Release date:2023-02-01
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (3 Å)
Cite:Structural insights into a cooperative switch between one and two FimH bacterial adhesins binding pauci- and high-mannose type N-glycan receptors
J.Biol.Chem., 299, 2023
8BY3
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BU of 8by3 by Molmil
FimH lectin domain in complex with oligomannose-6
Descriptor: NICKEL (II) ION, SULFATE ION, Type 1 fimbrin D-mannose specific adhesin, ...
Authors:Bouckaert, J, Bourenkov, G.P.
Deposit date:2022-12-11
Release date:2023-04-12
Last modified:2023-04-26
Method:X-RAY DIFFRACTION (3.186 Å)
Cite:Structural insights into a cooperative switch between one and two FimH bacterial adhesins binding pauci- and high-mannose type N-glycan receptors.
J.Biol.Chem., 299, 2023
8BVD
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BU of 8bvd by Molmil
FimH lectin domain in complex with mannose C-linked to quinoline
Descriptor: (2R,3S,4R,5S,6R)-2-(hydroxymethyl)-6-[(E)-3-quinolin-6-ylprop-2-enyl]oxane-3,4,5-triol, Type 1 fimbrin D-mannose specific adhesin
Authors:Bouckaert, J, Bridot, C.
Deposit date:2022-12-03
Release date:2023-02-15
Last modified:2023-03-08
Method:X-RAY DIFFRACTION (2.995 Å)
Cite:Insightful Improvement in the Design of Potent Uropathogenic E. coli FimH Antagonists.
Pharmaceutics, 15, 2023
5FS5
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BU of 5fs5 by Molmil
Breaking down the wall: mutation of the tyrosine gate of the universal Escherichia coli fimbrial adhesin FimH
Descriptor: FIMH, SODIUM ION, heptyl alpha-D-mannopyranoside
Authors:Bouckaert, J.
Deposit date:2015-12-30
Release date:2016-11-30
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.42 Å)
Cite:Mutation of Tyr137 of the universal Escherichia coli fimbrial adhesin FimH relaxes the tyrosine gate prior to mannose binding.
IUCrJ, 4, 2017
5FWR
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BU of 5fwr by Molmil
Breaking down the wall: mutation of the tyrosine gate of the universal Escherichia coli fimbrial adhesin FimH
Descriptor: FimH, biphenyl-4-yl alpha-D-mannopyranoside
Authors:Bouckaert, J.
Deposit date:2016-02-21
Release date:2016-11-30
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (2.13 Å)
Cite:Mutation of Tyr137 of the universal Escherichia coli fimbrial adhesin FimH relaxes the tyrosine gate prior to mannose binding.
IUCrJ, 4, 2017
5FX3
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BU of 5fx3 by Molmil
Breaking down the wall: mutation of the tyrosine gate of the universal Escherichia coli fimbrial adhesin FimH
Descriptor: FimH, {[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-CARBOXYMETHYL-AMINO}-ACETIC ACID
Authors:Bouckaert, J.
Deposit date:2016-02-22
Release date:2017-01-18
Last modified:2024-01-10
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Mutation of Tyr137 of the universal Escherichia coli fimbrial adhesin FimH relaxes the tyrosine gate prior to mannose binding.
IUCrJ, 4, 2017
1ONA
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BU of 1ona by Molmil
CO-CRYSTALS OF CONCANAVALIN A WITH METHYL-3,6-DI-O-(ALPHA-D-MANNOPYRANOSYL)-ALPHA-D-MANNOPYRANOSIDE
Descriptor: CALCIUM ION, CONCANAVALIN A, MANGANESE (II) ION, ...
Authors:Bouckaert, J, Maes, D, Poortmans, F, Wyns, L, Loris, R.
Deposit date:1996-07-07
Release date:1997-09-17
Last modified:2023-08-09
Method:X-RAY DIFFRACTION (2.35 Å)
Cite:A structure of the complex between concanavalin A and methyl-3,6-di-O-(alpha-D-mannopyranosyl)-alpha-D-mannopyranoside reveals two binding modes.
J.Biol.Chem., 271, 1996
4AV4
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BU of 4av4 by Molmil
FimH lectin domain co-crystal with a alpha-D-mannoside O-linked to a propynyl pyridine
Descriptor: 3-(pyridin-3-yl)prop-2-yn-1-yl alpha-D-mannopyranoside, FIMH
Authors:Bouckaert, J, Touaibia, M, Roos, G, Shiao, T.C, Wang, Q, Papadopoulos, A, Roy, R.
Deposit date:2012-05-23
Release date:2012-06-27
Last modified:2023-12-20
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:The Tyrosine Gate as a Potential Entropic Lever in the Receptor-Binding Site of the Bacterial Adhesin Fimh.
Biochemistry, 51, 2012

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