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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.
分子名称: GLUTAMATE RECEPTOR 2, GLUTAMIC ACID, N,N-DIMETHYL-4-[3-(TRIFLUOROMETHYL)-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL]BENZAMIDE, ...
著者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.
登録日2010-11-09
公開日2011-04-27
最終更新日2011-09-28
実験手法X-RAY DIFFRACTION (1.55 Å)
主引用文献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
5EHY
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BU of 5ehy by Molmil
Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle kinase 1 (MPS1) Using a Structure-Based Hydridization Approach
分子名称: 1,2-ETHANEDIOL, 2-(2-(2-(2-(2-(2-ETHOXYETHOXY)ETHOXY)ETHOXY)ETHOXY)ETHOXY)ETHANOL, 4-(furan-3-yl)-3-phenyl-2~{H}-pyrazolo[4,3-c]pyridine, ...
著者Innocenti, P, Woodward, H.L, Solanki, S, Naud, N, Westwood, I.M, Cronin, N, Hayes, A, Roberts, J, Henley, A.T, Baker, R, Faisal, A, Mak, G, Box, G, Valenti, M, De Haven Brandon, A, O'Fee, L, Saville, J, Schmitt, J, Burke, R, van Montfort, R.L.M, Raymaud, F.I, Eccles, S.A, Linardopoulos, S, Blagg, J, Hoelder, S.
登録日2015-10-29
公開日2016-04-20
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.26 Å)
主引用文献Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle Kinase 1 (MPS1) Using a Structure-Based Hybridization Approach.
J.Med.Chem., 59, 2016
3MZY
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BU of 3mzy by Molmil
The Crystal Structure of the RNA polymerase sigma-H factor from Fusobacterium nucleatum to 2.5A
分子名称: RNA polymerase sigma-H factor
著者Stein, A.J, Chhor, G, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2010-05-13
公開日2010-06-02
最終更新日2017-11-08
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献The Crystal Structure of the RNA polymerase sigma-H factor from Fusobacterium nucleatum to 2.5A
To be Published
5EI8
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BU of 5ei8 by Molmil
Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle kinase 1 (MPS1) Using a Structure-Based Hydridization Approach
分子名称: DIMETHYL SULFOXIDE, Dual specificity protein kinase TTK, ~{N}-[2-methoxy-4-(1-methylpyrazol-4-yl)phenyl]-8-(1-methylpyrazol-4-yl)pyrido[3,4-d]pyrimidin-2-amine
著者Innocenti, P, Woodward, H.L, Solanki, S, Naud, N, Westwood, I.M, Cronin, N, Hayes, A, Roberts, J, Henley, A.T, Baker, R, Faisal, A, Mak, G, Box, G, Valenti, M, De Haven Brandon, A, O'Fee, L, Saville, J, Schmitt, J, Burke, R, van Montfort, R.L.M, Raymaud, F.I, Eccles, S.A, Linardopoulos, S, Blagg, J, Hoelder, S.
登録日2015-10-29
公開日2016-04-20
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.17 Å)
主引用文献Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle Kinase 1 (MPS1) Using a Structure-Based Hybridization Approach.
J.Med.Chem., 59, 2016
3D6K
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BU of 3d6k by Molmil
The crystal structure of a putative aminotransferase from Corynebacterium diphtheriae
分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Putative aminotransferase, ...
著者Tan, K, Zhang, R, Duggan, E, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2008-05-19
公開日2008-07-15
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献The crystal structure of a putative aminotransferase from Corynebacterium diphtheriae
To be Published
3EY5
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BU of 3ey5 by Molmil
Putative acetyltransferase from GNAT family from Bacteroides thetaiotaomicron.
分子名称: Acetyltransferase-like, GNAT family, SULFATE ION
著者Osipiuk, J, Bigelow, L, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2008-10-17
公開日2008-11-18
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献X-ray crystal structure of putative acetyltransferase from GNAT family from Bacteroides thetaiotaomicron.
To be Published
3F0A
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BU of 3f0a by Molmil
Structure of a putative n-acetyltransferase (ta0374) in complex with acetyl-coa from thermoplasma acidophilum
分子名称: ACETYL COENZYME *A, CHLORIDE ION, N-ACETYLTRANSFERASE, ...
著者Filippova, E.V, Minasov, G, Shuvalova, L, Kiryukhina, O, Clancy, S, Joachimiak, A, Anderson, W.F, Midwest Center for Structural Genomics (MCSG)
登録日2008-10-24
公開日2008-11-11
最終更新日2023-11-15
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structure of the novel PaiA N-acetyltransferase from Thermoplasma acidophilum involved in the negative control of sporulation and degradative enzyme production.
Proteins, 79, 2011
3NE7
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BU of 3ne7 by Molmil
Crystal structure of paia n-acetyltransferase from thermoplasma acidophilum in complex with coenzyme a
分子名称: ACETYLTRANSFERASE, BETA-MERCAPTOETHANOL, COENZYME A, ...
著者Filippova, E.V, Minasov, G, Shuvalova, L, Kiryukhina, O, Clancy, S, Joachimiak, A, Anderson, F.W, Midwest Center for Structural Genomics (MCSG)
登録日2010-06-08
公開日2010-07-28
最終更新日2023-11-22
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal structure of the novel PaiA N-acetyltransferase from Thermoplasma acidophilum involved in the negative control of sporulation and degradative enzyme production.
Proteins, 79, 2011
3CJ8
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BU of 3cj8 by Molmil
Crystal structure of 2,3,4,5-tetrahydropyridine-2-carboxylate N-succinyltransferase from Enterococcus faecalis V583
分子名称: 2,3,4,5-tetrahydropyridine-2,6-dicarboxylate N-acetyltransferase, ACETATE ION, CHLORIDE ION, ...
著者Tan, K, Bigelow, L, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2008-03-12
公開日2008-03-25
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献The crystal structure of 2,3,4,5-tetrahydropyridine-2-carboxylate N-succinyltransferase from Enterococcus faecalis V583.
To be Published
1MNB
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BU of 1mnb by Molmil
BIV TAT PEPTIDE (RESIDUES 68-81), NMR, MINIMIZED AVERAGE STRUCTURE
分子名称: BIV TAR RNA, BIV TAT PEPTIDE
著者Puglisi, J.D, Chen, L, Blanchard, S, Frankel, A.D.
登録日1996-07-25
公開日1997-01-27
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献Solution structure of a bovine immunodeficiency virus Tat-TAR peptide-RNA complex.
Science, 270, 1995
1P7P
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BU of 1p7p by Molmil
Methionyl-tRNA synthetase from Escherichia coli complexed with methionine phosphonate
分子名称: (1-AMINO-3-METHYLSULFANYL-PROPYL)-PHOSPHONIC ACID, Methionyl-tRNA synthetase, ZINC ION
著者Crepin, T, Schmitt, E, Mechulam, Y, Sampson, P.B, Vaughan, M.D, Honek, J.F, Blanquet, S.
登録日2003-05-05
公開日2004-02-17
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Use of analogues of methionine and methionyl adenylate to sample conformational changes during catalysis in Escherichia coli methionyl-tRNA synthetase.
J.Mol.Biol., 332, 2003
3PSL
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BU of 3psl by Molmil
Fine-tuning the stimulation of MLL1 methyltransferase activity by a histone H3 based peptide mimetic
分子名称: N-alpha acetylated form of histone H3, WD repeat-containing protein 5
著者Avdic, V, Zhang, P, Lanouette, S, Voronova, A, Skerjanc, I, Couture, J.-F.
登録日2010-12-01
公開日2010-12-22
最終更新日2023-09-06
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献Fine-tuning the stimulation of MLL1 methyltransferase activity by a histone H3-based peptide mimetic.
Faseb J., 25, 2011
8B80
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BU of 8b80 by Molmil
The structure of Gan1D W433A in complex with galactose-6P
分子名称: 6-O-phosphono-beta-D-galactopyranose, GLYCEROL, IMIDAZOLE, ...
著者Snyder, J, Lansky, S, Zehavi, A, Shoham, Y, Shoham, G.
登録日2022-10-04
公開日2022-10-19
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.78 Å)
主引用文献The structure of Gan1D W433A in complex with galactose-6P
To Be Published
8B81
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BU of 8b81 by Molmil
The structure of Gan1D W433A in complex with cellobiose-6-phosphate
分子名称: 6-O-phosphono-beta-D-glucopyranose-(1-4)-beta-D-glucopyranose, IMIDAZOLE, Putative 6-phospho-beta-galactobiosidase
著者Snyder, J, Lansky, S, Zehavi, A, Shoham, Y, Shoham, G.
登録日2022-10-04
公開日2022-10-19
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.585 Å)
主引用文献The structure of Gan1D W433A in complex with cellobiose-6-phosphate
To Be Published
3CLQ
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BU of 3clq by Molmil
Crystal structure of a conserved protein of unknown function from Enterococcus faecalis V583
分子名称: DI(HYDROXYETHYL)ETHER, Uncharacterized protein
著者Tan, K, Duggan, E, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2008-03-19
公開日2008-04-08
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献The crystal structure of a conserved protein of unknown function from Enterococcus faecalis V583.
To be Published
3D0F
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BU of 3d0f by Molmil
Structure of the BIG_1156.2 domain of putative penicillin-binding protein MrcA from Nitrosomonas europaea ATCC 19718
分子名称: GLYCEROL, PHOSPHATE ION, Penicillin-binding 1 transmembrane protein MrcA
著者Cuff, M.E, Mulligan, R, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2008-05-01
公開日2008-07-01
最終更新日2017-10-25
実験手法X-RAY DIFFRACTION (1.64 Å)
主引用文献Structure of the BIG_1156.2 domain of putative penicillin-binding protein MrcA from Nitrosomonas europaea ATCC 19718.
TO BE PUBLISHED
3D3Y
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BU of 3d3y by Molmil
Crystal structure of a conserved protein from Enterococcus faecalis V583
分子名称: 1,2-ETHANEDIOL, ACETATE ION, Uncharacterized protein
著者Tan, K, Li, H, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2008-05-13
公開日2008-07-15
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献The crystal structure of a conserved protein from Enterococcus faecalis V583.
To be Published
3N2Q
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BU of 3n2q by Molmil
Crystal structure of Sex pheromone staph-cAM373 precursor
分子名称: Sex pheromone staph-cAM373
著者Chang, C, Chhor, G, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2010-05-18
公開日2010-06-02
最終更新日2017-11-08
実験手法X-RAY DIFFRACTION (2.55 Å)
主引用文献Crystal structure of Sex pheromone staph-cAM373 precursor
To be Published
5EHO
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BU of 5eho by Molmil
Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle kinase 1 (MPS1) Using a Structure-Based Hydridization Approach
分子名称: DIMETHYL SULFOXIDE, Dual specificity protein kinase TTK, ~{N}8-cyclohexyl-~{N}2-[2-methoxy-4-(1-methylpyrazol-4-yl)phenyl]pyrido[3,4-d]pyrimidine-2,8-diamine
著者Innocenti, P, Woodward, H.L, Solanki, S, Naud, N, Westwood, I.M, Cronin, N, Hayes, A, Roberts, J, Henley, A.T, Baker, R, Faisal, A, Mak, G, Box, G, Valenti, M, De Haven Brandon, A, O'Fee, L, Saville, J, Schmitt, J, Burke, R, van Montfort, R.L.M, Raymaud, F.I, Eccles, S.A, Linardopoulos, S, Blagg, J, Hoelder, S.
登録日2015-10-28
公開日2016-11-09
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.18 Å)
主引用文献Rapid Discovery of Pyrido[3,4-d]pyrimidine Inhibitors of Monopolar Spindle kinase 1 (MPS1) Using a Structure-Based Hydridization Approach
To Be Published
3CO5
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BU of 3co5 by Molmil
Crystal structure of sigma-54 interaction domain of putative transcriptional response regulator from Neisseria gonorrhoeae
分子名称: BETA-MERCAPTOETHANOL, Putative two-component system transcriptional response regulator
著者Osipiuk, J, Hendricks, R, Bigelow, L, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2008-03-27
公開日2008-04-08
最終更新日2017-10-25
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献X-ray crystal structure of Sigma-54 interaction domain of putative transcriptional response regulator from Neisseria gonorrhoeae.
To be Published
3TEV
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BU of 3tev by Molmil
The crystal structure of glycosyl hydrolase from Deinococcus radiodurans R1
分子名称: Glycosyl hyrolase, family 3
著者Chang, C, Hatzos-Skintges, C, Kohler, M, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2011-08-15
公開日2011-08-31
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献The crystal structure of glycosyl hydrolase from Deinococcus radiodurans R1
To be Published
3NBM
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BU of 3nbm by Molmil
The lactose-specific IIB component domain structure of the phosphoenolpyruvate:carbohydrate phosphotransferase system (PTS) from Streptococcus pneumoniae.
分子名称: GLYCEROL, PTS system, lactose-specific IIBC components
著者Cuff, M.E, Chhor, G, Clancy, S, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2010-06-03
公開日2010-09-08
最終更新日2017-11-08
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Structure of the lactose-specific IIB component domain of the phosphoenolpyruvate:carbohydrate phosphotransferase system (PTS) from Streptococcus pneumoniae.
TO BE PUBLISHED
1PFY
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BU of 1pfy by Molmil
METHIONYL-TRNA SYNTHETASE FROM ESCHERICHIA COLI COMPLEXED WITH METHIONYL SULPHAMOYL ADENOSINE
分子名称: 5'-O-[(L-METHIONYL)-SULPHAMOYL]ADENOSINE, Methionyl-tRNA synthetase, ZINC ION
著者Crepin, T, Schmitt, E, Mechulam, Y, Sampson, P.B, Vaughan, M.D, Honek, J.F, Blanquet, S.
登録日2003-05-27
公開日2004-02-17
最終更新日2023-08-16
実験手法X-RAY DIFFRACTION (1.93 Å)
主引用文献Use of analogues of methionine and methionyl adenylate to sample conformational changes during catalysis in Escherichia coli methionyl-tRNA synthetase.
J.Mol.Biol., 332, 2003
3F6N
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BU of 3f6n by Molmil
Crystal structure of the virion-associated protein P3 from Caulimovirus
分子名称: Virion-associated protein
著者Hoh, F, Uzest, M, Blanc, S, Dumas, C.
登録日2008-11-06
公開日2009-11-24
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Structural insights into the molecular mechanisms of cauliflower mosaic virus transmission by its insect vector.
J.Virol., 84, 2010
3OJ0
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BU of 3oj0 by Molmil
Crystal structure of glutamyl-tRNA reductase from Thermoplasma volcanium (nucleotide binding domain)
分子名称: GLYCEROL, Glutamyl-tRNA reductase, SULFATE ION
著者Michalska, K, Marshall, N, Clancy, S, Puttagunta, R, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
登録日2010-08-20
公開日2010-09-01
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.648 Å)
主引用文献Crystal structure of glutamyl-tRNA reductase from Thermoplasma volcanium (nucleotide binding domain)
To be Published

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