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6MWW
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BU of 6mww by Molmil
LasR LBD:BB0126 complex
Descriptor: 4-[3-(methylsulfonyl)phenoxy]-N-[(1R,3R,5R)-2-oxobicyclo[3.1.0]hexan-3-yl]butanamide, Transcriptional regulator LasR
Authors:Bassler, B.L, Paczkowski, J.E.
Deposit date:2018-10-30
Release date:2019-04-03
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.76 Å)
Cite:An Autoinducer Analogue Reveals an Alternative Mode of Ligand Binding for the LasR Quorum-Sensing Receptor.
Acs Chem.Biol., 14, 2019
6MVN
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BU of 6mvn by Molmil
LasR LBD L130F:3OC10HSL complex
Descriptor: 3-oxo-N-[(3S)-2-oxotetrahydrofuran-3-yl]decanamide, Transcriptional regulator LasR
Authors:Bassler, B.L, Paczkowski, J.E.
Deposit date:2018-10-26
Release date:2019-01-16
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structural determinants driving homoserine lactone ligand selection in thePseudomonas aeruginosaLasR quorum-sensing receptor.
Proc. Natl. Acad. Sci. U.S.A., 116, 2019
6MWL
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BU of 6mwl by Molmil
LasR LBD:mBTL complex
Descriptor: 4-(3-bromophenoxy)-N-[(3S)-2-oxothiolan-3-yl]butanamide, Transcriptional regulator LasR
Authors:Bassler, B.L, Paczkowski, J.E.
Deposit date:2018-10-29
Release date:2019-04-03
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:An Autoinducer Analogue Reveals an Alternative Mode of Ligand Binding for the LasR Quorum-Sensing Receptor.
Acs Chem.Biol., 14, 2019
6MWZ
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BU of 6mwz by Molmil
LasR LBD T75V/Y93F/A127W:BB0126
Descriptor: 4-[3-(methylsulfonyl)phenoxy]-N-[(1S,3S,5S)-2-oxobicyclo[3.1.0]hexan-3-yl]butanamide, ALA-HIS-HIS-HIS-HIS-ALA, Transcriptional regulator LasR
Authors:Bassler, B.L, Paczkowski, J.E.
Deposit date:2018-10-30
Release date:2019-04-03
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (1.657 Å)
Cite:An Autoinducer Analogue Reveals an Alternative Mode of Ligand Binding for the LasR Quorum-Sensing Receptor.
Acs Chem.Biol., 14, 2019
6MWH
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BU of 6mwh by Molmil
LasR LBD:BB0020 complex
Descriptor: 2-(3-bromophenoxy)-N-[(1S,2S,3R,5S)-2-hydroxybicyclo[3.1.0]hexan-3-yl]acetamide, Transcriptional regulator LasR
Authors:Bassler, B.L, Paczkowski, J.E.
Deposit date:2018-10-29
Release date:2019-04-03
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:An Autoinducer Analogue Reveals an Alternative Mode of Ligand Binding for the LasR Quorum-Sensing Receptor.
Acs Chem.Biol., 14, 2019
1Y6D
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BU of 1y6d by Molmil
Solution structure and dynamics of LuxU from Vibrio harveyi, a phosphotransferase protein involved in bacterial quorum sensing
Descriptor: Phosphorelay protein luxU
Authors:Ulrich, D.L, Kojetin, D, Bassler, B.L, Cavanagh, J, Loria, J.P.
Deposit date:2004-12-06
Release date:2004-12-14
Last modified:2024-05-22
Method:SOLUTION NMR
Cite:Solution structure and dynamics of LuxU from Vibrio harveyi, a phosphotransferase protein involved in bacterial quorum sensing.
J.Mol.Biol., 347, 2005
1JX6
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BU of 1jx6 by Molmil
CRYSTAL STRUCTURE OF LUXP FROM VIBRIO HARVEYI COMPLEXED WITH AUTOINDUCER-2
Descriptor: 3A-METHYL-5,6-DIHYDRO-FURO[2,3-D][1,3,2]DIOXABOROLE-2,2,6,6A-TETRAOL, CALCIUM ION, LUXP PROTEIN
Authors:Chen, X, Schauder, S, Potier, N, Van Dorsselaer, A, Pelczer, I, BassleR, B.L, Hughson, F.M.
Deposit date:2001-09-05
Release date:2002-02-04
Last modified:2024-02-07
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Structural identification of a bacterial quorum-sensing signal containing boron.
Nature, 415, 2002
6MVM
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BU of 6mvm by Molmil
LasR LBD L130F:3OC14HSL complex
Descriptor: 3-oxo-N-[(3S)-2-oxooxolan-3-yl]tetradecanamide, Transcriptional regulator LasR
Authors:Paczkowski, J.E, Bassler, B.L.
Deposit date:2018-10-26
Release date:2019-01-16
Last modified:2023-10-11
Method:X-RAY DIFFRACTION (1.895 Å)
Cite:An Autoinducer Analogue Reveals an Alternative Mode of Ligand Binding for the LasR Quorum-Sensing Receptor.
Acs Chem.Biol., 14, 2019
1ZHH
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BU of 1zhh by Molmil
Crystal Structure of the Apo Form of Vibrio Harveyi LUXP Complexed with the Periplasmic Domain of LUXQ
Descriptor: 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, Autoinducer 2 sensor kinase/phosphatase luxQ, Autoinducer 2-binding periplasmic protein luxP
Authors:Neiditch, M.B, Federle, M.J, Miller, S.T, Bassler, B.L, Hughson, F.M.
Deposit date:2005-04-25
Release date:2005-05-24
Last modified:2024-02-14
Method:X-RAY DIFFRACTION (1.94 Å)
Cite:Regulation of LuxPQ Receptor Activity by the Quorum-Sensing Signal Autoinducer-2.
Mol.Cell, 18, 2005
7TZ9
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BU of 7tz9 by Molmil
Structure of PQS Response Protein PqsE(E182W) Variant
Descriptor: FE (III) ION, Quinolone signal response protein
Authors:Jeffrey, P.D, Taylor, I.R, Bassler, B.L.
Deposit date:2022-02-15
Release date:2022-08-31
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:The PqsE Active Site as a Target for Small Molecule Antimicrobial Agents against Pseudomonas aeruginosa.
Biochemistry, 61, 2022
7TZA
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BU of 7tza by Molmil
Structure of PQS Response Protein PqsE in complex with N-(4-(3-neopentylureido)phenyl)-1H-indazole-7-carboxamide
Descriptor: 1,2-ETHANEDIOL, FE (III) ION, N-{4-[(2,2-dimethylpropyl)carbamamido]phenyl}-1H-indazole-7-carboxamide, ...
Authors:Jeffrey, P.D, Taylor, I.R, Bassler, B.L.
Deposit date:2022-02-15
Release date:2022-08-31
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:The PqsE Active Site as a Target for Small Molecule Antimicrobial Agents against Pseudomonas aeruginosa.
Biochemistry, 61, 2022
7U6G
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BU of 7u6g by Molmil
Structure of PQS Response Protein PqsE(E182W,E280A) Variant
Descriptor: FE (III) ION, Quinolone signal response protein
Authors:Jeffrey, P.D, Taylor, I.R, Bassler, B.L.
Deposit date:2022-03-04
Release date:2022-08-31
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2.45 Å)
Cite:The PqsE Active Site as a Target for Small Molecule Antimicrobial Agents against Pseudomonas aeruginosa.
Biochemistry, 61, 2022
1TJY
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BU of 1tjy by Molmil
Crystal Structure of Salmonella typhimurium AI-2 receptor LsrB in complex with R-THMF
Descriptor: (2R,4S)-2-methyl-2,3,3,4-tetrahydroxytetrahydrofuran, sugar transport protein
Authors:Miller, S.T, Xavier, K.B, Campagna, S.R, Taga, M.E, Semmelhack, M.F, Bassler, B.L, Hughson, F.M.
Deposit date:2004-06-07
Release date:2004-09-28
Last modified:2024-10-30
Method:X-RAY DIFFRACTION (1.3 Å)
Cite:Salmonella typhimurium Recognizes a Chemically Distinct Form of the Bacterial Quorum-Sensing Signal AI-2
Mol.Cell, 15, 2004
1TM2
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BU of 1tm2 by Molmil
Crystal Structure of the apo form of the Salmonella typhimurium AI-2 receptor LsrB
Descriptor: sugar transport protein
Authors:Miller, S.T, Xavier, K.B, Campagna, S.R, Taga, M.E, Semmelhack, M.F, Bassler, B.L, Hughson, F.M.
Deposit date:2004-06-10
Release date:2004-09-28
Last modified:2018-01-31
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Salmonella typhimurium Recognizes a Chemically Distinct Form of the Bacterial Quorum-Sensing Signal AI-2
Mol.Cell, 15, 2004
7KGX
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BU of 7kgx by Molmil
Structure of PQS Response Protein PqsE in Complex with 4-(3-(2-methyl-2-morpholinobutyl)ureido)-N-(thiazol-2-yl)benzamide
Descriptor: 2-aminobenzoylacetyl-CoA thioesterase, 4-({[(2R)-2-methyl-2-(morpholin-4-yl)butyl]carbamoyl}amino)-N-(1,3-thiazol-2-yl)benzamide, FE (III) ION
Authors:Jeffrey, P.D, Taylor, I.R, Bassler, B.L.
Deposit date:2020-10-19
Release date:2021-05-05
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (2 Å)
Cite:Inhibitor Mimetic Mutations in the Pseudomonas aeruginosa PqsE Enzyme Reveal a Protein-Protein Interaction with the Quorum-Sensing Receptor RhlR That Is Vital for Virulence Factor Production.
Acs Chem.Biol., 16, 2021
7KGW
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BU of 7kgw by Molmil
Structure of PQS Response Protein PqsE in Complex N-(3-(1H-pyrazol-5-yl)phenyl)-1H-indazole-7-carboxamide
Descriptor: 2-aminobenzoylacetyl-CoA thioesterase, FE (III) ION, N-[3-(1H-pyrazol-3-yl)phenyl]-1H-indazole-7-carboxamide
Authors:Jeffrey, P.D, Taylor, I.R, Bassler, B.L.
Deposit date:2020-10-19
Release date:2021-05-05
Last modified:2023-10-18
Method:X-RAY DIFFRACTION (1.99 Å)
Cite:Inhibitor Mimetic Mutations in the Pseudomonas aeruginosa PqsE Enzyme Reveal a Protein-Protein Interaction with the Quorum-Sensing Receptor RhlR That Is Vital for Virulence Factor Production.
Acs Chem.Biol., 16, 2021
6UGL
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BU of 6ugl by Molmil
VqmA bound to DPO
Descriptor: 3,5-dimethylpyrazin-2(1H)-one, Helix-turn-helix transcriptional regulator
Authors:Paczkowski, J.E, Huang, X.
Deposit date:2019-09-26
Release date:2020-01-29
Last modified:2024-03-13
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Mechanism underlying autoinducer recognition in theVibrio choleraeDPO-VqmA quorum-sensing pathway.
J.Biol.Chem., 295, 2020
3QP4
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BU of 3qp4 by Molmil
Crystal structure of CviR ligand-binding domain bound to C10-HSL
Descriptor: CviR transcriptional regulator, N-[(3S)-2-oxotetrahydrofuran-3-yl]decanamide
Authors:Chen, G, Swem, L, Swem, D, Stauff, D, O'Loughlin, C, Jeffrey, P, Bassler, B, Hughson, F.
Deposit date:2011-02-11
Release date:2011-03-30
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:A strategy for antagonizing quorum sensing.
Mol.Cell, 42, 2011
3QP2
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BU of 3qp2 by Molmil
Crystal structure of CviR ligand-binding domain bound to C8-HSL
Descriptor: CviR transcriptional regulator, N-(2-OXOTETRAHYDROFURAN-3-YL)OCTANAMIDE
Authors:Chen, G, Swem, L, Swem, D, Stauff, D, O'Loughlin, C, Jeffrey, P, Bassler, B, Hughson, F.
Deposit date:2011-02-11
Release date:2011-03-30
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.638 Å)
Cite:A strategy for antagonizing quorum sensing.
Mol.Cell, 42, 2011
3QP8
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BU of 3qp8 by Molmil
Crystal structure of CviR (Chromobacterium violaceum 12472) ligand-binding domain bound to C10-HSL
Descriptor: CviR transcriptional regulator, N-[(3S)-2-oxotetrahydrofuran-3-yl]decanamide
Authors:Chen, G, Swem, L, Swem, D, Stauff, D, O'Loughlin, C, Jeffrey, P, Bassler, B, Hughson, F.
Deposit date:2011-02-11
Release date:2011-03-30
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:A strategy for antagonizing quorum sensing.
Mol.Cell, 42, 2011
3QP5
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BU of 3qp5 by Molmil
Crystal structure of CviR bound to antagonist chlorolactone (CL)
Descriptor: 4-(4-chlorophenoxy)-N-[(3S)-2-oxotetrahydrofuran-3-yl]butanamide, CviR transcriptional regulator
Authors:Chen, G, Swem, L, Swem, D, Stauff, D, O'Loughlin, C, Jeffrey, P, Bassler, B, Hughson, F.
Deposit date:2011-02-11
Release date:2011-03-30
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (3.249 Å)
Cite:A strategy for antagonizing quorum sensing.
Mol.Cell, 42, 2011
3QP6
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BU of 3qp6 by Molmil
Crystal structure of CviR (Chromobacterium violaceum 12472) bound to C6-HSL
Descriptor: CviR transcriptional regulator, N-[(3S)-2-oxotetrahydrofuran-3-yl]hexanamide
Authors:Chen, G, Swem, L, Swem, D, Stauff, D, O'Loughlin, C, Jeffrey, P, Bassler, B, Hughson, F.
Deposit date:2011-02-11
Release date:2011-03-30
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (2 Å)
Cite:A strategy for antagonizing quorum sensing.
Mol.Cell, 42, 2011
3QP1
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BU of 3qp1 by Molmil
Crystal structure of CviR ligand-binding domain bound to the native ligand C6-HSL
Descriptor: CviR transcriptional regulator, N-[(3S)-2-oxotetrahydrofuran-3-yl]hexanamide
Authors:Chen, G, Swem, L, Swem, D, Stauff, D, O'Loughlin, C, Jeffrey, P, Bassler, B, Hughson, F.
Deposit date:2011-02-11
Release date:2011-03-30
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:A strategy for antagonizing quorum sensing.
Mol.Cell, 42, 2011
3KKI
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BU of 3kki by Molmil
PLP-Dependent Acyl-CoA transferase CqsA
Descriptor: 2,3-DIHYDROXY-1,4-DITHIOBUTANE, CAI-1 autoinducer synthase, MAGNESIUM ION, ...
Authors:Kelly, R.C, Jeffrey, P.D, Hughson, F.M.
Deposit date:2009-11-05
Release date:2009-11-24
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The Vibrio cholerae quorum-sensing autoinducer CAI-1: analysis of the biosynthetic enzyme CqsA.
Nat.Chem.Biol., 5, 2009
3HQT
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BU of 3hqt by Molmil
PLP-Dependent Acyl-CoA Transferase CqsA
Descriptor: CAI-1 autoinducer synthase, PYRIDOXAL-5'-PHOSPHATE
Authors:Kelly, R.C, Jeffrey, P.D, Hughson, F.M.
Deposit date:2009-06-08
Release date:2009-10-20
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (2.7 Å)
Cite:The Vibrio cholerae quorum-sensing autoinducer CAI-1: analysis of the biosynthetic enzyme CqsA.
Nat.Chem.Biol., 5, 2009

 

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