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4PUD
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BU of 4pud by Molmil
Extracellulr Xylanase from Geobacillus stearothermophilus: E159Q mutant, with xylopentaose in active site
Descriptor: CHLORIDE ION, Endo-1,4-beta-xylanase, ZINC ION, ...
Authors:Dann, R.D, Solomon, H.V, Lansky, S, Ben-David, A, Lavid, N, Salama, R, Shoham, Y, Shoham, G.
Deposit date:2014-03-13
Release date:2015-03-18
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.01 Å)
Cite:Extracellulr Xylanase from Geobacillus stearothermophilus: E159Q mutant, with xylopentaose in active site.
To be Published
4PRW
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BU of 4prw by Molmil
Xylanase T6 (XT6) from Geobacillus Stearothermophilus in complex with xylohexaose
Descriptor: CHLORIDE ION, Endo-1,4-beta-xylanase, SULFATE ION, ...
Authors:Dann, R.D, Solomon, H.V, Lansky, S, Ben-David, A, Lavid, N, Salama, R, Shoham, Y, Shoham, G.
Deposit date:2014-03-06
Release date:2015-03-11
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:Xylanase T6 (XT6) from Geobacillus Stearothermophilus in complex with xylohexaose
To be Published
2XXI
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BU of 2xxi by Molmil
Crystal structure of 1-((4-(3-(trifluoromethyl)-6,7-dihydropyrano(4,3- c(pyrazol-1(4H)-yl)phenyl)methyl)-2-pyrrolidinone in complex with the ligand binding domain of the Rat GluA2 receptor and glutamate at 1.6A resolution.
Descriptor: 1-({4-[3-(TRIFLUOROMETHYL)-6,7-DIHYDROPYRANO[4,3-C]PYRAZOL-1(4H)-YL]PHENYL}METHYL)-2-PYRROLIDINONE, GLUTAMATE RECEPTOR 2, GLUTAMIC ACID, ...
Authors:Ward, S.E, Harries, M, Aldegheri, L, Austin, N.E, Ballantine, S, Ballini, E, Bradley, D.M, Bax, B.D, Clarke, B.P, Harris, A.J, Harrison, S.A, Melarange, R.A, Mookherjee, C, Mosley, J, DalNegro, G, Oliosi, B, Smith, K.J, Thewlis, K.M, Woollard, P.M, Yusaf, S.P.
Deposit date:2010-11-10
Release date:2011-04-06
Last modified:2011-09-28
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Integration of Lead Optimization with Crystallography for a Membrane-Bound Ion Channel Target: Discovery of a New Class of Ampa Receptor Positive Allosteric Modulators.
J.Med.Chem., 54, 2011
2XX9
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BU of 2xx9 by Molmil
Crystal structure of 1-((2-fluoro-4-(3-(trifluoromethyl)-4,5,6,7- tetrahydro-1H-indazol-1-yl)phenyl)methyl)-2-pyrrolidinone in complex with the ligand binding domain of the Rat GluA2 receptor and glutamate at 2.2A resolution.
Descriptor: GLUTAMATE RECEPTOR 2, GLUTAMIC ACID, N,N-DIMETHYL-4-[3-(TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL]BENZAMIDE, ...
Authors:Ward, S.E, Harries, M, Aldegheri, L, Austin, N.E, Ballantine, S, Ballini, E, Bradley, D.M, Bax, B.D, Clarke, B.P, Harris, A.J, Harrison, S.A, Melarange, R.A, Mookherjee, C, Mosley, J, DalNegro, G, Oliosi, B, Smith, K.J, Thewlis, K.M, Woollard, P.M, Yusaf, S.P.
Deposit date:2010-11-09
Release date:2011-04-06
Last modified:2011-09-28
Method:X-RAY DIFFRACTION (1.97 Å)
Cite:Integration of Lead Optimization with Crystallography for a Membrane-Bound Ion Channel Target: Discovery of a New Class of Ampa Receptor Positive Allosteric Modulators.
J.Med.Chem., 54, 2011
4GS5
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BU of 4gs5 by Molmil
The crystal structure of acyl-CoA synthetase (AMP-forming)/AMP-acid ligase II-like protein from Dyadobacter fermentans DSM 18053
Descriptor: 1,2-ETHANEDIOL, Acyl-CoA synthetase (AMP-forming)/AMP-acid ligase II-like protein, IODIDE ION
Authors:Tan, K, Holowicki, J, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2012-08-27
Release date:2012-09-12
Method:X-RAY DIFFRACTION (2.018 Å)
Cite:The crystal structure of acyl-CoA synthetase (AMP-forming)/AMP-acid ligase II-like protein from Dyadobacter fermentans DSM 18053
To be Published
4PIB
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BU of 4pib by Molmil
Crystal Structure of Uncharacterized Conserved Protein PixA from Burkholderia thailandensis
Descriptor: 1,2-ETHANEDIOL, CALCIUM ION, CHLORIDE ION, ...
Authors:Kim, Y, Li, H, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2014-05-08
Release date:2014-07-02
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (2 Å)
Cite:Crystal Structure of Uncharacterized Conserved Protein PixA from Burkholderia thailandensis
To Be Published
4H7N
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BU of 4h7n by Molmil
The Structure of Putative Aldehyde Dehydrogenase PutA from Anabaena variabilis.
Descriptor: Aldehyde dehydrogenase, GLYCEROL
Authors:Cuff, M.E, Chhor, G, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2012-09-20
Release date:2012-10-10
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2 Å)
Cite:The Structure of Putative Aldehyde Dehydrogenase PutA from Anabaena variabilis.
TO BE PUBLISHED
4H3T
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BU of 4h3t by Molmil
Crystal structure of CRISPR-associated protein Cse1 from Acidimicrobium ferrooxidans
Descriptor: CRISPR-associated protein, Cse1 family, GLYCEROL
Authors:Michalska, K, Stols, L, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2012-09-14
Release date:2012-09-26
Method:X-RAY DIFFRACTION (2.03 Å)
Cite:Crystal structure of CRISPR-associated protein Cse1 from Acidimicrobium ferrooxidans
To be Published
4MPS
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BU of 4mps by Molmil
Crystal structure of rat Beta-galactoside alpha-2,6-sialyltransferase 1 (ST6GAL1), Northeast Structural Genomics Consortium Target RnR367A
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Beta-galactoside alpha-2,6-sialyltransferase 1
Authors:Forouhar, F, Meng, L, Milaninia, S, Seetharaman, J, Su, M, Kornhaber, G, Montelione, G.T, Hunt, J.F, Moremen, K.W, Tong, L, Northeast Structural Genomics Consortium (NESG)
Deposit date:2013-09-13
Release date:2013-09-25
Last modified:2020-07-29
Method:X-RAY DIFFRACTION (2.4 Å)
Cite:Enzymatic Basis for N-Glycan Sialylation: STRUCTURE OF RAT alpha 2,6-SIALYLTRANSFERASE (ST6GAL1) REVEALS CONSERVED AND UNIQUE FEATURES FOR GLYCAN SIALYLATION.
J.Biol.Chem., 288, 2013
4NAS
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BU of 4nas by Molmil
The crystal structure of a rubisco-like protein (MtnW) from Alicyclobacillus acidocaldarius subsp. acidocaldarius DSM 446
Descriptor: CALCIUM ION, CHLORIDE ION, FORMIC ACID, ...
Authors:Tan, K, Li, H, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2013-10-22
Release date:2013-11-13
Method:X-RAY DIFFRACTION (1.92 Å)
Cite:The crystal structure of a rubisco-like protein (MtnW) from Alicyclobacillus acidocaldarius subsp. acidocaldarius DSM 446.
To be Published
4HG2
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BU of 4hg2 by Molmil
The Structure of a Putative Type II Methyltransferase from Anaeromyxobacter dehalogenans.
Descriptor: 1,2-ETHANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Methyltransferase type 11
Authors:Cuff, M.E, Chhor, G, Clancy, S, Brown, R.N, Cort, J.R, Heffron, F, Nakayasu, E.S, Adkins, J.N, Joachimiak, A, Midwest Center for Structural Genomics (MCSG), Program for the Characterization of Secreted Effector Proteins (PCSEP)
Deposit date:2012-10-05
Release date:2012-10-17
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:The Structure of a Putative Type II Methyltransferase from Anaeromyxobacter dehalogenans.
TO BE PUBLISHED
2XX7
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BU of 2xx7 by Molmil
Crystal structure of 1-(4-(1-pyrrolidinylcarbonyl)phenyl)-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole in complex with the ligand binding domain of the Rat GluA2 receptor and glutamate at 2.2A resolution.
Descriptor: 1-[4-(1-PYRROLIDINYLCARBONYL)PHENYL]-3-(TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDRO-1H-INDAZOLE, GLUTAMATE RECEPTOR 2, GLUTAMIC ACID, ...
Authors:Ward, S.E, Harries, M, Aldegheri, L, Austin, N.E, Ballantine, S, Ballini, E, Bradley, D.M, Bax, B.D, Clarke, B.P, Harris, A.J, Harrison, S.A, Melarange, R.A, Mookherjee, C, Mosley, J, DalNegro, G, Oliosi, B, Smith, K.J, Thewlis, K.M, Woollard, P.M, Yusaf, S.P.
Deposit date:2010-11-09
Release date:2011-04-06
Last modified:2011-09-28
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Integration of Lead Optimization with Crystallography for a Membrane-Bound Ion Channel Target: Discovery of a New Class of Ampa Receptor Positive Allosteric Modulators.
J.Med.Chem., 54, 2011
2XXH
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BU of 2xxh by Molmil
Crystal structure of 1-(4-(2-oxo-2-(1-pyrrolidinyl)ethyl)phenyl)-3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazole in complex with the ligand binding domain of the Rat GluA2 receptor and glutamate at 1.5A resolution.
Descriptor: 1-{4-[2-OXO-2-(1-PYRROLIDINYL)ETHYL]PHENYL}-3-( TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDRO-1H-INDAZOLE, GLUTAMATE RECEPTOR 2, GLUTAMIC ACID, ...
Authors:Ward, S.E, Harries, M, Aldegheri, L, Austin, N.E, Ballantine, S, Ballini, E, Bradley, D.M, Bax, B.D, Clarke, B.P, Harris, A.J, Harrison, S.A, Melarange, R.A, Mookherjee, C, Mosley, J, DalNegro, G, Oliosi, B, Smith, K.J, Thewlis, K.M, Woollard, P.M, Yusaf, S.P.
Deposit date:2010-11-10
Release date:2011-04-06
Last modified:2011-09-28
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Integration of Lead Optimization with Crystallography for a Membrane-Bound Ion Channel Target: Discovery of a New Class of Ampa Receptor Positive Allosteric Modulators.
J.Med.Chem., 54, 2011
2XX8
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BU of 2xx8 by Molmil
Crystal structure of N,N-dimethyl-4-(3-(trifluoromethyl)-4,5,6,7- tetrahydro-1H-indazol-1-yl)benzamide in complex with the ligand binding domain of the Rat GluA2 receptor and glutamate at 2.2A resolution.
Descriptor: GLUTAMATE RECEPTOR 2, GLUTAMIC ACID, N,N-DIMETHYL-4-[3-(TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL]BENZAMIDE, ...
Authors:Ward, S.E, Harries, M, Aldegheri, L, Austin, N.E, Ballantine, S, Ballini, E, Bradley, D.M, Bax, B.D, Clarke, B.P, Harris, A.J, Harrison, S.A, Melarange, R.A, Mookherjee, C, Mosley, J, DalNegro, G, Oliosi, B, Smith, K.J, Thewlis, K.M, Woollard, P.M, Yusaf, S.P.
Deposit date:2010-11-09
Release date:2011-04-27
Last modified:2011-09-28
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Integration of Lead Optimization with Crystallography for a Membrane-Bound Ion Channel Target: Discovery of a New Class of Ampa Receptor Positive Allosteric Modulators.
J.Med.Chem., 54, 2011
4P7C
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BU of 4p7c by Molmil
Crystal structure of putative methyltransferase from Pseudomonas syringae pv. tomato
Descriptor: 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ACETATE ION, tRNA (mo5U34)-methyltransferase
Authors:Chang, C, Mack, J, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2014-03-26
Release date:2014-04-09
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Crystal structure of putative methyltransferase from Pseudomonas syringae pv. tomato
To Be Published
4PW0
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BU of 4pw0 by Molmil
Alpha/beta hydrolase fold protein from Chitinophaga pinensis
Descriptor: Alpha/beta hydrolase fold protein, CHLORIDE ION
Authors:Osipiuk, J, Tesar, C, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2014-03-18
Release date:2014-04-02
Last modified:2017-11-22
Method:X-RAY DIFFRACTION (1.48 Å)
Cite:Alpha/beta hydrolase fold protein from Chitinophaga pinensis.
To be Published
4H0C
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BU of 4h0c by Molmil
Crystal structure of phospholipase/Carboxylesterase from Dyadobacter fermentans DSM 18053
Descriptor: CITRIC ACID, GLYCEROL, Phospholipase/Carboxylesterase, ...
Authors:Chang, C, Holowicki, J, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2012-09-07
Release date:2012-09-26
Method:X-RAY DIFFRACTION (1.62 Å)
Cite:Crystal structure of phospholipase/Carboxylesterase from Dyadobacter fermentans DSM 18053
To be Published
4DIM
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BU of 4dim by Molmil
Crystal structure of phosphoribosylglycinamide synthetase from Anaerococcus prevotii
Descriptor: Phosphoribosylglycinamide synthetase
Authors:Michalska, K, Wu, R, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2012-01-31
Release date:2012-02-29
Method:X-RAY DIFFRACTION (2.61 Å)
Cite:Crystal structure of phosphoribosylglycinamide synthetase from Anaerococcus prevotii
To be Published
4E9C
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BU of 4e9c by Molmil
The structure of the polo-box domain (PBD) of polo-like kinase 1 (Plk1) in complex with LDPPLHSpTA phosphopeptide
Descriptor: 2-(2-METHOXYETHOXY)ETHANOL, GLYCEROL, LDPPLHSpTA phosphopeptide, ...
Authors:Sledz, P, Hyvonen, M, Lang, S, Stubbs, C.J, Abell, C.
Deposit date:2012-03-21
Release date:2012-10-10
Last modified:2023-09-13
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:High-throughput interrogation of ligand binding mode using a fluorescence-based assay.
Angew. Chem. Int. Ed. Engl., 51, 2012
4MQD
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BU of 4mqd by Molmil
Crystal structure of ComJ, inhibitor of the DNA degrading activity of NucA, from Bacillus subtilis
Descriptor: DNA-entry nuclease inhibitor
Authors:Chang, C, Mack, J, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2013-09-16
Release date:2013-10-09
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (2.16 Å)
Cite:Crystal structure of ComJ, inhibitor of the DNA degrading activity of NucA, from Bacillus subtilis
To be Published
2ZC2
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BU of 2zc2 by Molmil
Crystal structure of DnaD-like replication protein from Streptococcus mutans UA159, gi 24377835, residues 127-199
Descriptor: DnaD-like replication protein, ZINC ION
Authors:Duke, N.E.C, Clancy, S, Duggan, E, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2007-11-02
Release date:2007-12-25
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (2.1 Å)
Cite:Crystal Structure of DnaD-like replication protein from Streptococcus mutans UA159.
To be Published
4Q6W
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BU of 4q6w by Molmil
Crystal Structure of Periplasmic Binding Protein type 1 from Bordetella pertussis Tohama I complexed with 3-Hydroxy Benzoic Acid
Descriptor: 1,2-ETHANEDIOL, 3-HYDROXYBENZOIC ACID, GLYCEROL, ...
Authors:Kim, Y, Joachimiak, G, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2014-04-23
Release date:2014-07-02
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:Crystal Structure of Periplasmic Binding Protein type 1 from Bordetella pertussis Tohama I complexed with 3-Hydroxy Benzoic Acid
To be Published, 2014
5NW7
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BU of 5nw7 by Molmil
Crystal structure of candida albicans phosphomannose isomerase in complex with inhibitor
Descriptor: Mannose-6-phosphate isomerase, ZINC ION, [(2~{R},3~{R},4~{S})-5-diazanyl-2,3,4-tris(oxidanyl)-5-oxidanylidene-pentyl] dihydrogen phosphate
Authors:Li de la Sierra-Gallay, I, Ahmad, L, Plancqueel, S, van Tilbeurgh, H, Salmon, L.
Deposit date:2017-05-05
Release date:2018-05-02
Last modified:2024-01-17
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Crystal structure of phosphomannose isomerase from Candida albicans complexed with 5-phospho-d-arabinonhydrazide.
FEBS Lett., 592, 2018
4GYM
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BU of 4gym by Molmil
Crystal structure of Glyoxalase/bleomycin resistance protein/dioxygenase from Conexibacter woesei DSM 14684
Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Glyoxalase/bleomycin resistance protein/dioxygenase, POTASSIUM ION, ...
Authors:Chang, C, Tesar, C, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2012-09-05
Release date:2012-09-26
Method:X-RAY DIFFRACTION (1.56 Å)
Cite:Crystal structure of Glyoxalase/bleomycin resistance protein/dioxygenase from Conexibacter woesei DSM 14684
To be Published
4HES
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BU of 4hes by Molmil
Structure of a Beta-Lactamase Class A-like Protein from Veillonella parvula.
Descriptor: Beta-lactamase class A-like protein, FORMIC ACID, GLYCEROL, ...
Authors:Cuff, M.E, Li, H, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2012-10-04
Release date:2012-10-17
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:Structure of a Beta-Lactamase Class A-like Protein from Veillonella parvula.
TO BE PUBLISHED

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