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4H9T
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Structure of Geobacillus kaustophilus lactonase, mutant E101N with bound N-butyryl-DL-homoserine lactone
分子名称: FE (III) ION, MANGANESE (II) ION, N-[(3S)-2-oxotetrahydrofuran-3-yl]butanamide, ...
著者Xue, B, Chow, J.Y, Yew, W.S, Robinson, R.C.
登録日2012-09-24
公開日2012-11-07
最終更新日2013-05-22
実験手法X-RAY DIFFRACTION (2.097 Å)
主引用文献Structural evidence of a productive active site architecture for an evolved quorum-quenching GKL lactonase.
Biochemistry, 52, 2013
4HBV
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Crystal Structure of the first bromodomain of human BRD4 in complex with a quinazolin ligand
分子名称: 1,2-ETHANEDIOL, 6-bromo-3-methyl-3,4-dihydroquinazolin-2(1H)-one, Bromodomain-containing protein 4
著者Filippakopoulos, P, Picaud, S, Qi, J, Felletar, I, von Delft, F, Bountra, C, Arrowsmith, C.H, Edwards, A, Fish, P.V, Bunnage, M.E, Cook, A.S, Owen, D.R, Knapp, S, Structural Genomics Consortium (SGC)
登録日2012-09-28
公開日2012-10-31
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.63 Å)
主引用文献Identification of a Chemical Probe for Bromo and Extra C-Terminal Bromodomain Inhibition through Optimization of a Fragment-Derived Hit.
J.Med.Chem., 55, 2012
4HAQ
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Crystal Structure of a GH7 family cellobiohydrolase from Limnoria quadripunctata in complex with cellobiose and cellotriose
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CALCIUM ION, GH7 family protein, ...
著者Martin, R.N.A, McGeehan, J.E, Streeter, S.D, Cragg, S.M, Guille, M.J, Schnorr, K.M, Kern, M, Bruce, N.C, McQueen-Mason, S.J.
登録日2012-09-27
公開日2013-06-12
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structural characterization of a unique marine animal family 7 cellobiohydrolase suggests a mechanism of cellulase salt tolerance
Proc.Natl.Acad.Sci.USA, 110, 2013
4GPJ
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Crystal Structure of the first bromodomain of human BRD4 in complex with a isoxazolylbenzimidazole ligand
分子名称: (1R)-6-(3,5-dimethyl-1,2-oxazol-4-yl)-1-phenyl-2,3-dihydro-1H-inden-1-ol, 1,2-ETHANEDIOL, Bromodomain-containing protein 4, ...
著者Filippakopoulos, P, Picaud, S, Qi, J, Felletar, I, Heightman, T.D, Brennan, P, von Delft, F, Bountra, C, Arrowsmith, C.H, Edwards, A, Knapp, S, Structural Genomics Consortium (SGC)
登録日2012-08-21
公開日2012-10-17
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献The design and synthesis of 5- and 6-isoxazolylbenzimidazoles as selective inhibitors of the BET bromodomains.
Medchemcomm, 4, 2013
4HBW
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Crystal Structure of the first bromodomain of human BRD4 in complex with a quinazoline ligand
分子名称: 1,2-ETHANEDIOL, Bromodomain-containing protein 4, N-ethyl-3-methyl-2-oxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide, ...
著者Filippakopoulos, P, Picaud, S, Qi, J, Felletar, I, von Delft, F, Bountra, C, Arrowsmith, C.H, Edwards, A, Fish, P.V, Bunnage, M.E, Cook, A.S, Owen, D.R, Knapp, S, Structural Genomics Consortium (SGC)
登録日2012-09-28
公開日2012-10-31
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.69 Å)
主引用文献Identification of a Chemical Probe for Bromo and Extra C-Terminal Bromodomain Inhibition through Optimization of a Fragment-Derived Hit.
J.Med.Chem., 55, 2012
4GUN
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BU of 4gun by Molmil
Crystal Structure of the K184R, L185P mutant manganese superoxide dismutase from Candida albicans cytosol
分子名称: MANGANESE (II) ION, SULFATE ION, Superoxide dismutase
著者Sheng, Y, Cascio, D, Valentine, J.S.
登録日2012-08-29
公開日2013-09-18
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (1.94 Å)
主引用文献Crystal Structure of the K184R, L185P mutant manganese superoxide dismutase from Candida albicans cytosol
TO BE PUBLISHED
4GWA
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Crystal Structure of a GH7 Family Cellobiohydrolase from Limnoria quadripunctata
分子名称: GH7 family protein, MAGNESIUM ION
著者McGeehan, J.E, Martin, R.N.A, Streeter, S.D, Cragg, S.M, Guille, M.J, Schnorr, K.M, Kern, M, Bruce, N.C, McQueen-Mason, S.J.
登録日2012-09-01
公開日2013-06-12
最終更新日2019-12-25
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Structural characterization of a unique marine animal family 7 cellobiohydrolase suggests a mechanism of cellulase salt tolerance
Proc.Natl.Acad.Sci.USA, 110, 2013
4HXM
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Brd4 Bromodomain 1 complex with N-{3-(2-OXO-2,3-DIHYDRO-1,3-THIAZOL-4-YL)-5-[(THIOPHEN-2-YLSULFONYL)AMINO]PHENYL}BUTANAMIDE inhibitor
分子名称: Bromodomain-containing protein 4, N-{3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-5-[(thiophen-2-ylsulfonyl)amino]phenyl}butanamide
著者Chen, T.T, Cao, D.Y, Chen, W.Y, Xiong, B, Shen, J.K, Xu, Y.C.
登録日2012-11-12
公開日2013-04-03
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.5 Å)
主引用文献Fragment-Based Drug Discovery of 2-Thiazolidinones as Inhibitors of the Histone Reader BRD4 Bromodomain.
J.Med.Chem., 56, 2013
4HZ7
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Crystal structure of BglB with glucose
分子名称: beta-D-glucopyranose, beta-glucosidase
著者Hwang, K.Y, Nam, K.H.
登録日2012-11-14
公開日2012-12-19
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structural insights into the substrate recognition properties of beta-glucosidase.
Biochem.Biophys.Res.Commun., 391, 2010
4HXL
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BU of 4hxl by Molmil
Brd4 Bromodomain 1 complex with 3-CYCLOHEXYL-N-{3-(2-OXO-2,3-DIHYDRO-1,3-THIAZOL-4-YL)-5-[(THIOPHEN-2-YLSULFONYL)AMINO]PHENYL}PROPANAMIDE inhibitor
分子名称: 3-cyclohexyl-N-{3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-5-[(thiophen-2-ylsulfonyl)amino]phenyl}propanamide, Bromodomain-containing protein 4
著者Chen, T.T, Cao, D.Y, Chen, W.Y, Xiong, B, Shen, J.K, Xu, Y.C.
登録日2012-11-12
公開日2013-04-03
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (1.52 Å)
主引用文献Fragment-Based Drug Discovery of 2-Thiazolidinones as Inhibitors of the Histone Reader BRD4 Bromodomain.
J.Med.Chem., 56, 2013
4I7A
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BU of 4i7a by Molmil
GrpN pentameric microcompartment shell protein from Rhodospirillum rubrum
分子名称: CHLORIDE ION, Ethanolamine utilization protein EutN/carboxysome structural protein Ccml
著者Wheatley, N.M, Gidaniyan, S.D, Cascio, D, Yeates, T.O.
登録日2012-11-30
公開日2013-05-01
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (3.2 Å)
主引用文献Bacterial microcompartment shells of diverse functional types possess pentameric vertex proteins.
Protein Sci., 22, 2013
4HZ6
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BU of 4hz6 by Molmil
crystal structure of BglB
分子名称: Beta-glucosidase, GLYCEROL
著者Hwang, K.Y, Nam, K.H.
登録日2012-11-14
公開日2012-12-19
最終更新日2023-11-08
実験手法X-RAY DIFFRACTION (1.4 Å)
主引用文献Structural insights into the substrate recognition properties of beta-glucosidase.
Biochem.Biophys.Res.Commun., 391, 2010
4JFE
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BU of 4jfe by Molmil
Preservation of peptide specificity during TCR-MHC contact dominated affinity enhancement of a melanoma-specific TCR
分子名称: Beta-2-microglobulin, GLYCEROL, HLA class I histocompatibility antigen, ...
著者Rizkallah, P.J, Cole, D.K, Madura, F, Sewell, A.K.
登録日2013-02-28
公開日2013-05-29
最終更新日2017-11-15
実験手法X-RAY DIFFRACTION (2.7 Å)
主引用文献T-cell receptor specificity maintained by altered thermodynamics.
J.Biol.Chem., 288, 2013
4K20
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Crystal structure of Canavalia boliviana lectin
分子名称: CALCIUM ION, Canavalia boliviana lectin, MANGANESE (II) ION
著者Viertlmayr, R, Bezerra, G.A, Moura, T.R, Delatorre, P, Rocha, B.A.M, Cavada, B.S, Gruber, K.
登録日2013-04-07
公開日2014-04-09
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (3.4 Å)
主引用文献Structural Studies of an Anti-Inflammatory Lectin from Canavalia boliviana Seeds in Complex with Dimannosides.
Plos One, 9, 2014
4K2K
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BU of 4k2k by Molmil
Crystal structure of Staphylococcal nuclease variant Delta+PHS L25A/L36A/I92A at cryogenic temperature
分子名称: CALCIUM ION, THYMIDINE-3',5'-DIPHOSPHATE, Thermonuclease
著者Caro, J.A, Schlessman, J.L, Heroux, A, Garcia-Moreno E, B.
登録日2013-04-09
公開日2013-04-24
最終更新日2023-09-20
実験手法X-RAY DIFFRACTION (1.65 Å)
主引用文献Pressure effects on proteins
To be Published
4GX7
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BU of 4gx7 by Molmil
Vibrio Cholerae Cytolysin Beta-Prism Domain With Methyl-Alpha-Mannose Bound
分子名称: Cytolysin and hemolysin HlyA Pore-forming toxin, methyl alpha-D-mannopyranoside
著者Levan, S, Olson, R.
登録日2012-09-04
公開日2013-01-02
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.85 Å)
主引用文献Vibrio cholerae Cytolysin Recognizes the Heptasaccharide Core of Complex N-Glycans with Nanomolar Affinity.
J.Mol.Biol., 425, 2013
4H9X
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BU of 4h9x by Molmil
Structure of Geobacillus kaustophilus lactonase, mutant E101G/R230C/D266N with Zn2+ and bound N-butyryl-DL-homoserine lactone
分子名称: FE (III) ION, HYDROXIDE ION, N-[(3S)-2-oxotetrahydrofuran-3-yl]butanamide, ...
著者Xue, B, Chow, J.Y, Yew, W.S, Robinson, R.C.
登録日2012-09-25
公開日2012-11-07
最終更新日2013-05-22
実験手法X-RAY DIFFRACTION (2.201 Å)
主引用文献Structural evidence of a productive active site architecture for an evolved quorum-quenching GKL lactonase.
Biochemistry, 52, 2013
4H1U
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BU of 4h1u by Molmil
Nucleotide-free human dynamin-1-like protein GTPase-GED fusion
分子名称: CITRATE ANION, Dynamin-1-like protein
著者Wenger, J, Klinglmayr, E, Puehringer, S, Goettig, P.
登録日2012-09-11
公開日2013-08-21
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Functional Mapping of Human Dynamin-1-Like GTPase Domain Based on X-ray Structure Analyses.
Plos One, 8, 2013
4K1Z
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BU of 4k1z by Molmil
Crystal structure of Canavalia boliviana lectin in complex with Man1-4Man-OMe
分子名称: CADMIUM ION, CALCIUM ION, CHLORIDE ION, ...
著者Bezerra, G.A, Viertlmayr, R, Moura, T.R, Delatorre, P, Rocha, B.A.M, Cavada, B.S, Gruber, K.
登録日2013-04-07
公開日2014-04-09
最終更新日2024-02-28
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Structural Studies of an Anti-Inflammatory Lectin from Canavalia boliviana Seeds in Complex with Dimannosides.
Plos One, 9, 2014
4JZJ
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BU of 4jzj by Molmil
Crystal Structure of Receptor-Fab Complex
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Fab Heavy Chain, Fab Light Chain, ...
著者Broughton, S.E, Parker, M.W.
登録日2013-04-03
公開日2014-04-09
最終更新日2020-07-29
実験手法X-RAY DIFFRACTION (2.801 Å)
主引用文献Dual mechanism of interleukin-3 receptor blockade by an anti-cancer antibody
Cell Rep, 8, 2014
4KAG
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BU of 4kag by Molmil
Crystal structure analysis of a single amino acid deletion mutation in EGFP
分子名称: 1,2-ETHANEDIOL, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Green fluorescent protein, ...
著者Arpino, J.A.J, Rizkallah, P.J.
登録日2013-04-22
公開日2014-08-06
最終更新日2023-12-06
実験手法X-RAY DIFFRACTION (1.12 Å)
主引用文献Structural and dynamic changes associated with beneficial engineered single-amino-acid deletion mutations in enhanced green fluorescent protein.
Acta Crystallogr.,Sect.D, 70, 2014
4H9Y
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Structure of Geobacillus kaustophilus lactonase, mutant E101N with Zn2+
分子名称: FE (III) ION, HYDROXIDE ION, Phosphotriesterase, ...
著者Xue, B, Chow, J.Y, Yew, W.S, Robinson, R.C.
登録日2012-09-25
公開日2012-11-07
最終更新日2013-05-22
実験手法X-RAY DIFFRACTION (2.085 Å)
主引用文献Structural evidence of a productive active site architecture for an evolved quorum-quenching GKL lactonase.
Biochemistry, 52, 2013
4H1V
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GMP-PNP bound dynamin-1-like protein GTPase-GED fusion
分子名称: Dynamin-1-like protein, PHOSPHOAMINOPHOSPHONIC ACID-GUANYLATE ESTER
著者Wenger, J, Klinglmayr, E, Eibl, C, Hessenberger, M, Goettig, P.
登録日2012-09-11
公開日2013-08-21
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Functional Mapping of Human Dynamin-1-Like GTPase Domain Based on X-ray Structure Analyses.
Plos One, 8, 2013
4H7M
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The X-ray Crystal Structure of the Trichoderma harzianum Endoglucanase 3 from family GH12
分子名称: Endo-1,4-beta-glucanase
著者Liberato, M.V, Polikarpov, I.
登録日2012-09-20
公開日2013-04-03
実験手法X-RAY DIFFRACTION (2.068 Å)
主引用文献X-ray Structure and Molecular Dynamics Simulations of Endoglucanase 3 from Trichoderma harzianum: Structural Organization and Substrate Recognition by Endoglucanases That Lack Cellulose Binding Module.
Plos One, 8, 2013
4H9Z
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Structure of Geobacillus kaustophilus lactonase, mutant E101N with Mn2+
分子名称: FE (III) ION, MANGANESE (II) ION, Phosphotriesterase
著者Xue, B, Chow, J.Y, Yew, W.S, Robinson, R.C.
登録日2012-09-25
公開日2012-11-07
最終更新日2013-05-22
実験手法X-RAY DIFFRACTION (2.6 Å)
主引用文献Structural evidence of a productive active site architecture for an evolved quorum-quenching GKL lactonase.
Biochemistry, 52, 2013

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