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2VXY
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BU of 2vxy by Molmil
The structure of FTsZ from Bacillus subtilis at 1.7A resolution
分子名称: CELL DIVISION PROTEIN FTSZ, CITRIC ACID, POTASSIUM ION
著者Barynin, V.V, Baker, P.J, Rice, D.W, Sedelnikova, S.E, Haydon, D.J, Stokes, N.R, Ure, R, Galbraith, G, Bennett, J.M, Brown, D.R, Heal, J.R, Sheridan, J.M, Aiwale, S.T, Chauhan, P.K, Srivastava, A, Taneja, A, Collins, I, Errington, J, Czaplewski, L.G.
登録日2008-07-15
公開日2008-09-30
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.7 Å)
主引用文献An Inhibitor of Ftsz with Potent and Selective Anti-Staphylococcal Activity.
Science, 321, 2008
6ZT9
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BU of 6zt9 by Molmil
X-ray structure of mutated arabinofuranosidase
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ACETATE ION, ...
著者Tandrup, T, Lo Leggio, L, Zhao, J, Bissaro, B, Barbe, S, Andre, I, Dumon, C, O'Donohue, M.J, Faure, R.
登録日2020-07-17
公開日2021-02-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Probing the determinants of the transglycosylation/hydrolysis partition in a retaining alpha-l-arabinofuranosidase.
N Biotechnol, 62, 2021
6ZTA
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BU of 6zta by Molmil
X-ray structure of mutated arabinofuranosidase
分子名称: Alpha-L-arabinofuranosidase
著者Tandrup, T, Lo Leggio, L, Zhao, J, Bissaro, B, Barbe, S, Andre, I, Dumon, C, O'Donohue, M.J, Faure, R.
登録日2020-07-17
公開日2021-02-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (3.1 Å)
主引用文献Probing the determinants of the transglycosylation/hydrolysis partition in a retaining alpha-l-arabinofuranosidase.
N Biotechnol, 62, 2021
6ZT8
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BU of 6zt8 by Molmil
X-ray structure of mutated arabinofuranosidase
分子名称: Alpha-L-arabinofuranosidase, CHLORIDE ION, PENTAETHYLENE GLYCOL, ...
著者Tandrup, T, Lo Leggio, L, Zhao, J, Bissaro, B, Barbe, S, Andre, I, Dumon, C, O'Donohue, M.J, Faure, R.
登録日2020-07-17
公開日2021-02-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Probing the determinants of the transglycosylation/hydrolysis partition in a retaining alpha-l-arabinofuranosidase.
N Biotechnol, 62, 2021
6ZT6
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BU of 6zt6 by Molmil
X-ray structure of mutated arabinofuranosidase
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Alpha-L-arabinofuranosidase
著者Tandrup, T, Lo Leggio, L, Zhao, J, Bissaro, B, Barbe, S, Andre, I, Dumon, C, O'Donohue, M.J, Faure, R.
登録日2020-07-17
公開日2021-02-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Probing the determinants of the transglycosylation/hydrolysis partition in a retaining alpha-l-arabinofuranosidase.
N Biotechnol, 62, 2021
6ZT7
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BU of 6zt7 by Molmil
X-ray structure of mutated arabinofuranosidase
分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, 2-[BIS-(2-HYDROXY-ETHYL)-AMINO]-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ACETATE ION, ...
著者Tandrup, T, Lo Leggio, L, Zhao, J, Bissaro, B, Barbe, S, Andre, I, Dumon, C, O'Donohue, M.J, Faure, R.
登録日2020-07-17
公開日2021-02-10
最終更新日2024-01-31
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Probing the determinants of the transglycosylation/hydrolysis partition in a retaining alpha-l-arabinofuranosidase.
N Biotechnol, 62, 2021
2CAL
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BU of 2cal by Molmil
Crystal structure of His143Met rusticyanin
分子名称: COPPER (I) ION, RUSTICYANIN
著者Barrett, M.L, Harvey, I, Sundararajan, M, Surendran, R, Hall, J.F, Ellis, M.J, Hough, M.A, Strange, R.W, Hillier, I.H, Hasnain, S.S.
登録日2005-12-21
公開日2006-01-05
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.1 Å)
主引用文献Atomic Resolution Crystal Structures, Exafs, and Quantum Chemical Studies of Rusticyanin and its Two Mutants Provide Insight Into its Unusual Properties.
Biochemistry, 45, 2006
2CAK
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BU of 2cak by Molmil
1.27Angstrom Structure of Rusticyanin from Thiobacillus ferrooxidans
分子名称: COPPER (I) ION, RUSTICYANIN
著者Barrett, M.L, Harvey, I, Sundararajan, M, Surendran, R, Hall, J.F, Ellis, M.J, Hough, M.A, Strange, R.W, Hillier, I.H, Hasnain, S.S.
登録日2005-12-21
公開日2006-03-08
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.27 Å)
主引用文献Atomic Resolution Crystal Structures, Exafs, and Quantum Chemical Studies of Rusticyanin and its Two Mutants Provide Insight Into its Unusual Properties.
Biochemistry, 45, 2006
4RN4
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BU of 4rn4 by Molmil
Human Carbonic anhydrases II in complex with a acetazolamide derivative comprising one hydrophobic and one hydrophilic tail moiety
分子名称: 2-({[1-(beta-D-glucopyranosyl)-1H-1,2,3-triazol-4-yl]methyl}[(1-phenyl-1H-1,2,3-triazol-4-yl)methyl]amino)-5-sulfamoyl-1,3,4-thiadiazole, Carbonic anhydrase 2, FORMIC ACID, ...
著者Ren, B, Tanpure, R, Peat, T.S, Bornaghi, L.F, Vullo, D, Supuran, C.T, Poulsen, S.
登録日2014-10-22
公開日2015-01-28
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.53 Å)
主引用文献Carbonic anhydrase inhibitors with dual-tail moieties to match the hydrophobic and hydrophilic halves of the carbonic anhydrase active site.
J.Med.Chem., 58, 2015
8OI4
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BU of 8oi4 by Molmil
Metagenomic Beta-galactosidase from Glycoside Hydrolase family GH154
分子名称: Beta-galactosidase, CHLORIDE ION, GLYCEROL
著者Pijning, T, Hameleers, L, Jurak, E, Guskov, A.
登録日2023-03-22
公開日2024-01-31
実験手法X-RAY DIFFRACTION (1.76 Å)
主引用文献Novel beta-galactosidase activity and first crystal structure of Glycoside Hydrolase family 154.
N Biotechnol, 80, 2023
7TOJ
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BU of 7toj by Molmil
Crystal structure of carbohydrate esterase CspAcXE, apoenzyme
分子名称: CHLORIDE ION, SGNH/GDSL hydrolase family protein
著者Stogios, P.J, Skarina, T, Di Leo, R, Jurak, E, Master, E.
登録日2022-01-24
公開日2022-04-13
最終更新日2022-11-02
実験手法X-RAY DIFFRACTION (1.3 Å)
主引用文献Elucidating Sequence and Structural Determinants of Carbohydrate Esterases for Complete Deacetylation of Substituted Xylans.
Molecules, 27, 2022
7TOH
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BU of 7toh by Molmil
Crystal structure of carbohydrate esterase PbeAcXE, in complex with MeGlcpA-Xylp
分子名称: 4-O-methyl-alpha-D-glucopyranuronic acid-(1-2)-beta-D-xylopyranose, SGNH hydrolase
著者Stogios, P.J, Skarina, T, Di Leo, R, Jurak, E, Master, E.
登録日2022-01-24
公開日2022-04-13
最終更新日2022-11-02
実験手法X-RAY DIFFRACTION (1.26 Å)
主引用文献Elucidating Sequence and Structural Determinants of Carbohydrate Esterases for Complete Deacetylation of Substituted Xylans.
Molecules, 27, 2022
7TOK
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BU of 7tok by Molmil
Crystal structure of the CBM domain of carbohydrate esterase FjoAcXE
分子名称: Acetylxylan esterase I
著者Stogios, P.J, Skarina, T, Di Leo, R, Jurak, E, Master, E.
登録日2022-01-24
公開日2022-04-13
最終更新日2022-11-02
実験手法X-RAY DIFFRACTION (2.45 Å)
主引用文献Elucidating Sequence and Structural Determinants of Carbohydrate Esterases for Complete Deacetylation of Substituted Xylans.
Molecules, 27, 2022
7TOG
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BU of 7tog by Molmil
Crystal structure of carbohydrate esterase PbeAcXE, apoenzyme
分子名称: SGNH hydrolase
著者Stogios, P.J, Skarina, T, Di Leo, R, Jurak, E, Master, E.
登録日2022-01-24
公開日2022-04-13
最終更新日2022-11-02
実験手法X-RAY DIFFRACTION (1.35 Å)
主引用文献Elucidating Sequence and Structural Determinants of Carbohydrate Esterases for Complete Deacetylation of Substituted Xylans.
Molecules, 27, 2022
7TOI
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BU of 7toi by Molmil
Crystal structure of carbohydrate esterase PbeAcXE, in complex with acetate
分子名称: ACETATE ION, SGNH hydrolase
著者Stogios, P.J, Skarina, T, Di Leo, R, Jurak, E, Master, E.
登録日2022-01-24
公開日2022-04-13
最終更新日2022-11-02
実験手法X-RAY DIFFRACTION (1.13 Å)
主引用文献Elucidating Sequence and Structural Determinants of Carbohydrate Esterases for Complete Deacetylation of Substituted Xylans.
Molecules, 27, 2022
6TKX
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BU of 6tkx by Molmil
Carbohydrate esterase from gut microbiota
分子名称: Carbohydrate esterase, SULFATE ION
著者Penttinen, L, Hakulinen, N, Master, R.E.
登録日2019-11-29
公開日2020-12-16
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (2.06 Å)
主引用文献Polysaccharide utilization loci-driven enzyme discovery reveals BD-FAE: a bifunctional feruloyl and acetyl xylan esterase active on complex natural xylans.
Biotechnol Biofuels, 14, 2021
6NWS
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BU of 6nws by Molmil
RORgamma Ligand Binding Domain
分子名称: 2-chloro-6-fluoro-N-(1-{[3-(trifluoromethyl)phenyl]sulfonyl}-2,3-dihydro-1H-indol-6-yl)benzamide, Nuclear receptor ROR-gamma
著者Strutzenberg, T.S, Park, H.J, Griffin, P.R.
登録日2019-02-07
公開日2019-07-10
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.44 Å)
主引用文献HDX-MS reveals structural determinants for ROR gamma hyperactivation by synthetic agonists.
Elife, 8, 2019
6NWT
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BU of 6nwt by Molmil
RORgamma Ligand Binding Domain
分子名称: 1,1,1,3,3,3-hexafluoro-2-[2-fluoro-4'-({4-[(pyridin-4-yl)methyl]piperazin-1-yl}methyl)[1,1'-biphenyl]-4-yl]propan-2-ol, Nuclear receptor ROR-gamma
著者Strutzenberg, T.S, Park, H, Griffin, P.R.
登録日2019-02-07
公開日2019-07-10
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献HDX-MS reveals structural determinants for ROR gamma hyperactivation by synthetic agonists.
Elife, 8, 2019
6NWU
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BU of 6nwu by Molmil
RORgamma Ligand Binding Domain
分子名称: 6-[(3,5-dichloropyridin-4-yl)methoxy]-1-{[3-(trifluoromethyl)phenyl]sulfonyl}-2,3-dihydro-1H-indole, Nuclear receptor ROR-gamma
著者Strutzenberg, T.S, Park, H, Griffin, P.R.
登録日2019-02-07
公開日2019-07-10
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献HDX-MS reveals structural determinants for ROR gamma hyperactivation by synthetic agonists.
Elife, 8, 2019
6XYC
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BU of 6xyc by Molmil
Truncated form of carbohydrate esterase from gut microbiota
分子名称: 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE, Acetyl xylan esterase
著者Penttinen, L, Hakulinen, N, Master, E.
登録日2020-01-30
公開日2021-01-27
最終更新日2024-01-24
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Polysaccharide utilization loci-driven enzyme discovery reveals BD-FAE: a bifunctional feruloyl and acetyl xylan esterase active on complex natural xylans.
Biotechnol Biofuels, 14, 2021
5KYV
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BU of 5kyv by Molmil
Structure of Photinus pyralis Luciferase green shifted light emitting variant
分子名称: 5'-O-[N-(DEHYDROLUCIFERYL)-SULFAMOYL] ADENOSINE, L(+)-TARTARIC ACID, Luciferin 4-monooxygenase
著者Gulick, A.M.
登録日2016-07-22
公開日2016-12-21
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Cloning of the Orange Light-Producing Luciferase from Photinus scintillans Provides Insight into Bioluminescence Color Determination
To Be Published
5KYT
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BU of 5kyt by Molmil
Structure of Photinus pyralis Luciferase red light emitting variant
分子名称: 1,2-ETHANEDIOL, 5'-O-[N-(DEHYDROLUCIFERYL)-SULFAMOYL] ADENOSINE, Luciferin 4-monooxygenase
著者Gulick, A.M.
登録日2016-07-22
公開日2016-12-21
最終更新日2023-10-04
実験手法X-RAY DIFFRACTION (2.001 Å)
主引用文献Cloning of the Orange Light-Producing Luciferase from Photinus scintillans-A New Proposal on how Bioluminescence Color is Determined.
Photochem. Photobiol., 93, 2017
5TO8
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BU of 5to8 by Molmil
Selectivity switch between FAK and Pyk2: Macrocyclization of FAK inhibitors improves Pyk2 potency
分子名称: 25-(methylsulfonyl)-8-(trifluoromethyl)-5,17,18,21,22,23,24,25-octahydro-12H-7,11-(azeno)-16,13-(metheno)pyrido[3,2-i]pyrrolo[1,2-q][1,3,7,11,17]pentaazacyclohenicosin-20(6H)-one, Protein-tyrosine kinase 2-beta
著者Newby, Z.E.
登録日2016-10-17
公開日2016-12-21
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (1.9849 Å)
主引用文献Selectivity switch between FAK and Pyk2: Macrocyclization of FAK inhibitors improves Pyk2 potency.
Bioorg. Med. Chem. Lett., 26, 2016
5TOB
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BU of 5tob by Molmil
Selectivity switch between FAK and Pyk2: Macrocyclization of FAK inhibitors improves Pyk2 potency
分子名称: N-methyl-N-{3-[({2-[(2-oxo-2,3-dihydro-1H-indol-5-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl}amino)methyl]pyridin-2-yl}methanesulfonamide, Protein-tyrosine kinase 2-beta
著者Newby, Z.E.
登録日2016-10-17
公開日2017-11-29
最終更新日2024-03-06
実験手法X-RAY DIFFRACTION (2.117 Å)
主引用文献Selectivity switch between FAK and Pyk2: Macrocyclization of FAK inhibitors improves Pyk2 potency.
Bioorg. Med. Chem. Lett., 26, 2016
4NRT
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BU of 4nrt by Molmil
Human Norovirus polymerase bound to Compound 6 (suramin derivative)
分子名称: 4-({4-methyl-3-[(3-nitrobenzoyl)amino]benzoyl}amino)naphthalene-1,5-disulfonic acid, hNV-RdRp
著者Croci, R, Pezzullo, M, Tarantino, D, Mastrangelo, E, Milani, M, Bolognesi, M.
登録日2013-11-27
公開日2014-10-15
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (2.022 Å)
主引用文献Structural bases of norovirus RNA dependent RNA polymerase inhibition by novel suramin-related compounds.
Plos One, 9, 2014

 

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