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4H91
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BU of 4h91 by Molmil
Radiation damage study of lysozyme - 0.35 MGy
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Lysozyme C
Authors:Sutton, K.A, Snell, E.H.
Deposit date:2012-09-24
Release date:2013-05-15
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (1.2002 Å)
Cite:Insights into the mechanism of X-ray-induced disulfide-bond cleavage in lysozyme crystals based on EPR, optical absorption and X-ray diffraction studies.
Acta Crystallogr.,Sect.D, 69, 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
Descriptor: FE (III) ION, HYDROXIDE ION, N-[(3S)-2-oxotetrahydrofuran-3-yl]butanamide, ...
Authors:Xue, B, Chow, J.Y, Yew, W.S, Robinson, R.C.
Deposit date:2012-09-25
Release date:2012-11-07
Last modified:2013-05-22
Method:X-RAY DIFFRACTION (2.201 Å)
Cite:Structural evidence of a productive active site architecture for an evolved quorum-quenching GKL lactonase.
Biochemistry, 52, 2013
4HBD
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BU of 4hbd by Molmil
Crystal structure of KANK2 ankyrin repeats
Descriptor: KN motif and ankyrin repeat domain-containing protein 2, UNKNOWN ATOM OR ION
Authors:Xu, C, Tempel, W, Cerovina, T, El Bakkouri, M, Bountra, C, Arrowsmith, C.H, Edwards, A.M, Min, J, Structural Genomics Consortium (SGC)
Deposit date:2012-09-27
Release date:2012-12-12
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.72 Å)
Cite:Crystal structure of KANK2 ankyrin repeats
To be Published
4GRX
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BU of 4grx by Molmil
Structure of an omega-aminotransferase from Paracoccus denitrificans
Descriptor: Aminotransferase, DELTA-AMINO VALERIC ACID, SODIUM ION
Authors:Rausch, C, Lerchner, A, Schiefner, A, Skerra, A.
Deposit date:2012-08-27
Release date:2012-12-19
Last modified:2023-11-15
Method:X-RAY DIFFRACTION (2.6 Å)
Cite:Crystal structure of the omega-aminotransferase from Paracoccus denitrificans and its phylogenetic relationship with other class III aminotransferases that have biotechnological potential.
Proteins, 81, 2013
3FC4
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BU of 3fc4 by Molmil
Ethylene glycol inhibited form of Aldehyde oxidoreductase from Desulfovibrio gigas
Descriptor: (MOLYBDOPTERIN-CYTOSINE DINUCLEOTIDE-S,S)-DIOXO-AQUA-MOLYBDENUM(V), 1,2-ETHANEDIOL, Aldehyde oxidoreductase, ...
Authors:Santos-Silva, T, Romao, M.J.
Deposit date:2008-11-21
Release date:2009-10-06
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.79 Å)
Cite:Kinetic, structural, and EPR studies reveal that aldehyde oxidoreductase from Desulfovibrio gigas does not need a sulfido ligand for catalysis and give evidence for a direct Mo-C interaction in a biological system.
J.Am.Chem.Soc., 131, 2009
3FDJ
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BU of 3fdj by Molmil
The structure of a DegV family protein from Eubacterium eligens.
Descriptor: 1,2-ETHANEDIOL, ACETIC ACID, DegV family protein, ...
Authors:Cuff, M.E, Hendricks, R, Freeman, L, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2008-11-25
Release date:2009-02-03
Last modified:2023-12-27
Method:X-RAY DIFFRACTION (1.8 Å)
Cite:The structure of a DegV family protein from Eubacterium eligens.
TO BE PUBLISHED
3FPF
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BU of 3fpf by Molmil
Crystal Structure of MtNAS in complex with MTA and tNA
Descriptor: 5'-DEOXY-5'-METHYLTHIOADENOSINE, BROMIDE ION, N-[(3S)-3-{[(3S)-3-amino-3-carboxypropyl]amino}-3-carboxypropyl]-L-glutamic acid, ...
Authors:Dreyfus, C, Pignol, D, Arnoux, P.
Deposit date:2009-01-05
Release date:2009-10-06
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.66 Å)
Cite:Crystallographic snapshots of iterative substrate translocations during nicotianamine synthesis in Archaea
Proc.Natl.Acad.Sci.USA, 106, 2009
3FKC
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BU of 3fkc by Molmil
Crystal Structure of Human Zinc finger and BTB domain containing 33
Descriptor: Transcriptional regulator Kaiso
Authors:Filippakopoulos, P, Bullock, A, Keates, T, Burgess-Brown, N, Muniz, J, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Weigelt, J, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC)
Deposit date:2008-12-16
Release date:2008-12-23
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.7 Å)
Cite:Crystal Structure of Human Zinc finger and BTB domain containing 33
To be Published
4I80
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BU of 4i80 by Molmil
Crystal structure of human menin in complex with a high-affinity macrocyclic peptidomimetics
Descriptor: Menin, macrocyclic peptidomimetic
Authors:Huang, J, Lei, M.
Deposit date:2012-12-01
Release date:2013-03-06
Last modified:2017-11-15
Method:X-RAY DIFFRACTION (3.1 Å)
Cite:Structure-Based Design of High-Affinity Macrocyclic Peptidomimetics to Block the Menin-Mixed Lineage Leukemia 1 (MLL1) Protein-Protein Interaction.
J.Med.Chem., 56, 2013
4I8D
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BU of 4i8d by Molmil
Crystal Structure of Beta-D-glucoside glucohydrolase from Trichoderma reesei
Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, Beta-D-glucoside glucohydrolase, alpha-D-mannopyranose-(1-2)-alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-3)-[alpha-D-mannopyranose-(1-6)]alpha-D-mannopyranose-(1-6)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Helmich, K.E, Banerjee, G, Bianchetti, C.M, Gudmundsson, M, Sandgren, M, Walton, J.D, Phillips Jr, G.N, Center for Eukaryotic Structural Genomics (CESG)
Deposit date:2012-12-03
Release date:2012-12-19
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.48 Å)
Cite:Biochemical Characterization and Crystal Structures of a Fungal Family 3 beta-Glucosidase, Cel3A from Hypocrea jecorina.
J.Biol.Chem., 289, 2014
3FMB
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BU of 3fmb by Molmil
Crystal structure of dimeric protein of unknown function and ferredoxin-like fold (YP_212648.1) from Bacteroides fragilis NCTC 9343 at 1.85 A resolution
Descriptor: 1,2-ETHANEDIOL, Dimeric protein of unknown function and ferredoxin-like fold, SULFATE ION
Authors:Joint Center for Structural Genomics (JCSG)
Deposit date:2008-12-19
Release date:2009-01-27
Last modified:2023-02-01
Method:X-RAY DIFFRACTION (1.85 Å)
Cite:Crystal structure of dimeric protein of unknown function and ferredoxin-like fold (YP_212648.1) from Bacteroides fragilis NCTC 9343 at 1.85 A resolution
To be published
4IA5
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BU of 4ia5 by Molmil
Hydratase from Lactobacillus acidophilus - SeMet derivative (apo LAH)
Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, GLYCEROL, ...
Authors:Khoshnevis, S, Neumann, P, Ficner, R.
Deposit date:2012-12-06
Release date:2013-03-27
Last modified:2013-08-07
Method:X-RAY DIFFRACTION (2.22 Å)
Cite:Crystal structure analysis of a fatty acid double-bond hydratase from Lactobacillus acidophilus
Acta Crystallogr.,Sect.D, 69, 2013
4HXM
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BU of 4hxm by Molmil
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
Descriptor: Bromodomain-containing protein 4, N-{3-(2-oxo-2,3-dihydro-1,3-thiazol-4-yl)-5-[(thiophen-2-ylsulfonyl)amino]phenyl}butanamide
Authors:Chen, T.T, Cao, D.Y, Chen, W.Y, Xiong, B, Shen, J.K, Xu, Y.C.
Deposit date:2012-11-12
Release date:2013-04-03
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Fragment-Based Drug Discovery of 2-Thiazolidinones as Inhibitors of the Histone Reader BRD4 Bromodomain.
J.Med.Chem., 56, 2013
3FX3
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BU of 3fx3 by Molmil
Structure of a putative cAMP-binding regulatory protein from Silicibacter pomeroyi DSS-3
Descriptor: Cyclic nucleotide-binding protein, GLYCEROL, PHOSPHATE ION
Authors:Cuff, M.E, Zhou, M, Freeman, L, Joachimiak, A, Midwest Center for Structural Genomics (MCSG)
Deposit date:2009-01-19
Release date:2009-03-24
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (2.2 Å)
Cite:Structure of a putative cAMP-binding regulatory protein from Silicibacter pomeroyi DSS-3
TO BE PUBLISHED
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
Descriptor: 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
Authors:Chen, T.T, Cao, D.Y, Chen, W.Y, Xiong, B, Shen, J.K, Xu, Y.C.
Deposit date:2012-11-12
Release date:2013-04-03
Last modified:2024-02-28
Method:X-RAY DIFFRACTION (1.52 Å)
Cite:Fragment-Based Drug Discovery of 2-Thiazolidinones as Inhibitors of the Histone Reader BRD4 Bromodomain.
J.Med.Chem., 56, 2013
4HYT
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BU of 4hyt by Molmil
Na,K-ATPase in the E2P state with bound ouabain and Mg2+ in the cation-binding site
Descriptor: 1-O-decanoyl-beta-D-tagatofuranosyl beta-D-allopyranoside, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ...
Authors:Laursen, M, Yatime, L, Nissen, P, Fedosova, N.U.
Deposit date:2012-11-14
Release date:2013-06-26
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (3.404 Å)
Cite:Crystal structure of the high-affinity Na+,K+-ATPase-ouabain complex with Mg2+ bound in the cation binding site.
Proc.Natl.Acad.Sci.USA, 110, 2013
3G02
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BU of 3g02 by Molmil
Structure of enantioselective mutant of epoxide hydrolase from Aspergillus niger generated by directed evolution
Descriptor: Epoxide hydrolase, FORMIC ACID
Authors:Naworyta, A, Mowbray, S.L.
Deposit date:2009-01-27
Release date:2009-06-09
Last modified:2023-11-01
Method:X-RAY DIFFRACTION (1.5 Å)
Cite:Directed evolution of an enantioselective epoxide hydrolase: uncovering the source of enantioselectivity at each evolutionary stage
J.Am.Chem.Soc., 131, 2009
4I0W
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BU of 4i0w by Molmil
Structure of the Clostridium Perfringens CspB protease
Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, Protease CspB, ...
Authors:Adams, C.M, Eckenroth, B.E, Doublie, S.
Deposit date:2012-11-19
Release date:2013-04-03
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structural and functional analysis of the CspB protease required for Clostridium spore germination.
Plos Pathog., 9, 2013
4I34
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BU of 4i34 by Molmil
Crystal Structure of W-W-W ClpX Hexamer
Descriptor: ATP-dependent Clp protease ATP-binding subunit ClpX, SULFATE ION
Authors:Glynn, S.E, Nager, A.R, Stinson, B.S, Schmitz, K.R, Baker, T.A, Sauer, R.T.
Deposit date:2012-11-23
Release date:2013-05-15
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (4.1218 Å)
Cite:Nucleotide Binding and Conformational Switching in the Hexameric Ring of a AAA+ Machine.
Cell(Cambridge,Mass.), 153, 2013
4I4I
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BU of 4i4i by Molmil
Crystal Structure of Bacillus stearothermophilus Phosphofructokinase mutant T156A bound to PEP
Descriptor: 6-phosphofructokinase, PHOSPHOENOLPYRUVATE
Authors:Mosser, R, Reddy, M, Bruning, J.B, Sacchettini, J.C, Reinhart, G.D.
Deposit date:2012-11-27
Release date:2013-07-31
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (2.4948 Å)
Cite:Redefining the Role of the Quaternary Shift in Bacillus stearothermophilus Phosphofructokinase.
Biochemistry, 52, 2013
3G4E
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BU of 3g4e by Molmil
Crystal structure of human senescence marker protein-30(SMP30)(Calcium bound)
Descriptor: CALCIUM ION, Regucalcin
Authors:Chakraborti, S, Bahnson, B.J.
Deposit date:2009-02-03
Release date:2010-02-02
Last modified:2023-09-06
Method:X-RAY DIFFRACTION (1.42 Å)
Cite:Crystal structure of human senescence marker protein 30: insights linking structural, enzymatic, and physiological functions .
Biochemistry, 49, 2010
3FTO
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BU of 3fto by Molmil
Crystal structure of OppA in a open conformation
Descriptor: Oligopeptide-binding protein oppA
Authors:Berntsson, R.P.-A, Oktaviani, N.A, Fusetti, F, Thunnissen, A.-M.W.H, Poolman, B, Slotboom, D.-J.
Deposit date:2009-01-13
Release date:2009-03-31
Last modified:2017-11-01
Method:X-RAY DIFFRACTION (2.38 Å)
Cite:Selenomethionine incorporation in proteins expressed in Lactococcus lactis.
Protein Sci., 18, 2009
4I70
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BU of 4i70 by Molmil
Crystal structure of the Trypanosoma brucei Inosine-Adenosine-Guanosine nucleoside hydrolase
Descriptor: CALCIUM ION, Inosine-adenosine-guanosine-nucleoside hydrolase
Authors:Giannese, F, Degano, M.
Deposit date:2012-11-30
Release date:2013-08-07
Last modified:2024-04-03
Method:X-RAY DIFFRACTION (1.6 Å)
Cite:Structures of purine nucleosidase from Trypanosoma brucei bound to isozyme-specific trypanocidals and a novel metalorganic inhibitor
Acta Crystallogr.,Sect.D, 69, 2013
4I7A
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BU of 4i7a by Molmil
GrpN pentameric microcompartment shell protein from Rhodospirillum rubrum
Descriptor: CHLORIDE ION, Ethanolamine utilization protein EutN/carboxysome structural protein Ccml
Authors:Wheatley, N.M, Gidaniyan, S.D, Cascio, D, Yeates, T.O.
Deposit date:2012-11-30
Release date:2013-05-01
Last modified:2023-09-20
Method:X-RAY DIFFRACTION (3.2 Å)
Cite:Bacterial microcompartment shells of diverse functional types possess pentameric vertex proteins.
Protein Sci., 22, 2013
4I9Z
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BU of 4i9z by Molmil
Crystal structure of the PDE5A1 catalytic domain in complex with novel inhibitors
Descriptor: 5-bromo-2-{5-[(4-methylpiperazin-1-yl)acetyl]-2-propoxyphenyl}-6-(propan-2-yl)pyrimidin-4(3H)-one, DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, ...
Authors:Ren, J, Chen, T, Xu, Y.
Deposit date:2012-12-05
Release date:2014-01-01
Last modified:2023-11-08
Method:X-RAY DIFFRACTION (2.08 Å)
Cite:Exploration of the 5-bromopyrimidin-4(3H)-ones as potent inhibitors of PDE5.
Bioorg.Med.Chem.Lett., 23, 2013

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數據於2024-07-10公開中

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