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5MZU
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BU of 5mzu by Molmil
Crystal structure of the myosin chaperone UNC-45 from C. elegans (alternative conformation)
分子名称: UNC-45
著者Hellerschmied, D, Gazda, L, Clausen, T.
登録日2017-02-01
公開日2018-02-14
実験手法X-RAY DIFFRACTION (3.8 Å)
主引用文献UFD-2 is an adaptor-assisted E3 ligase targeting unfolded proteins.
Nat Commun, 9, 2018
2N5U
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BU of 2n5u by Molmil
Solution structure of the cyanobacterial cytochrome b6f complex subunit PetP
分子名称: Tsr0524 protein
著者Veit, S, Ikegami, T, Roegner, M, Stoll, R.
登録日2015-07-29
公開日2016-04-13
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献The cyanobacterial cytochrome b6f subunit PetP adopts an SH3 fold in solution
Biochim.Biophys.Acta, 1857, 2016
3MNN
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BU of 3mnn by Molmil
A Ruthenium Antitumour Agent Forms Specific Histone Protein Adducts in the Nucleosome Core
分子名称: 1,3,5-triaza-7-phosphatricyclo[3.3.1.1~3,7~]decane, 1-methyl-4-(1-methylethyl)benzene, DNA (145-MER), ...
著者Ong, M.S, Davey, C.A.
登録日2010-04-22
公開日2011-04-06
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献A ruthenium antimetastasis agent forms specific histone protein adducts in the nucleosome core
Chemistry, 17, 2011
5CLV
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BU of 5clv by Molmil
Crystal Structure of KorA-operator DNA complex (KorA-OA)
分子名称: 5'-D(CP*CP*AP*AP*GP*TP*TP*TP*AP*GP*CP*TP*AP*AP*AP*CP*TP*TP*GP*GP*)-3', TrfB transcriptional repressor protein
著者White, S.A, Hyde, E.I, Rajasekar, K.V.
登録日2015-07-16
公開日2016-04-06
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Flexibility of KorA, a plasmid-encoded, global transcription regulator, in the presence and the absence of its operator.
Nucleic Acids Res., 44, 2016
5CKT
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BU of 5ckt by Molmil
Crystal Structure of KorA, a plasmid-encoded, global transcription regulator
分子名称: ACETATE ION, TrfB transcriptional repressor protein
著者White, S.A, Hyde, E.I, Lovering, A.L.
登録日2015-07-15
公開日2016-04-06
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Flexibility of KorA, a plasmid-encoded, global transcription regulator, in the presence and the absence of its operator.
Nucleic Acids Res., 44, 2016
5CM3
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BU of 5cm3 by Molmil
Crystal Structure of KorA, a plasmid-encoded, global transcription regulator
分子名称: 5'-D(CP*CP*AP*AP*GP*TP*TP*TP*AP*GP*CP*TP*AP*AP*AP*CP*TP*TP*GP*GP*)-3', TrfB transcriptional repressor protein
著者White, S.A, Hyde, E.I, Rajasekar, K.V.
登録日2015-07-16
公開日2016-04-06
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.302 Å)
主引用文献Flexibility of KorA, a plasmid-encoded, global transcription regulator, in the presence and the absence of its operator.
Nucleic Acids Res., 44, 2016
5IFR
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BU of 5ifr by Molmil
Structure of the stable UBE2D3-UbDha conjugate
分子名称: GLYCEROL, Polyubiquitin-B, Ubiquitin-conjugating enzyme E2 D3
著者Pruneda, J.N, Mulder, M.P.C, Witting, K, Ovaa, H, Komander, D.
登録日2016-02-26
公開日2016-05-11
最終更新日2024-01-10
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献A cascading activity-based probe sequentially targets E1-E2-E3 ubiquitin enzymes.
Nat.Chem.Biol., 12, 2016
4KGC
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BU of 4kgc by Molmil
Nucleosome Core Particle Containing (ETA6-P-CYMENE)-(1, 2-ETHYLENEDIAMINE)-RUTHENIUM
分子名称: (ethane-1,2-diamine-kappa~2~N,N')[(1,2,3,4,5,6-eta)-1-methyl-4-(propan-2-yl)cyclohexane-1,2,3,4,5,6-hexayl]ruthenium, DNA (145-mer), Histone H2A, ...
著者Adhireksan, Z, Davey, C.A.
登録日2013-04-29
公開日2014-03-26
最終更新日2024-03-20
実験手法X-RAY DIFFRACTION (2.69 Å)
主引用文献Ligand substitutions between ruthenium-cymene compounds can control protein versus DNA targeting and anticancer activity
Nat Commun, 5, 2014
2VUW
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BU of 2vuw by Molmil
Structure of human haspin kinase domain
分子名称: (2R,3R,4S,5R)-2-(4-AMINO-5-IODO-7H-PYRROLO[2,3-D]PYRIMIDIN-7-YL)-5-(HYDROXYMETHYL)TETRAHYDROFURAN-3,4-DIOL, (4S)-2-METHYL-2,4-PENTANEDIOL, DIMETHYL SULFOXIDE, ...
著者Eswaran, J, Murray, J.W, Filippakopoulos, P, Soundararajan, M, Pike, A.C.W, von Delft, F, Picaud, S, Keates, T, King, O, Wickstroem, M, Bountra, C, Edwards, A.M, Arrowsmith, C.H, Fedorov, O, Burgess-Brown, N, Bray, J, Knapp, S.
登録日2008-05-30
公開日2008-09-16
最終更新日2024-05-01
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Structure and Functional Characterization of the Atypical Human Kinase Haspin.
Proc.Natl.Acad.Sci.USA, 106, 2009
2LX5
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BU of 2lx5 by Molmil
NMR solution structure of peptide epsilon(103-120) from Mycobacterium tuberculosis F-ATPsynthase
分子名称: ATP synthase epsilon chain
著者Basak, S, Rishikesan, S, Gruber, G.
登録日2012-08-14
公開日2012-11-07
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献Variations of Subunit {varepsilon} of the Mycobacterium tuberculosis F1Fo ATP Synthase and a Novel Model for Mechanism of Action of the Tuberculosis Drug TMC207.
Antimicrob.Agents Chemother., 57, 2013
3AZC
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BU of 3azc by Molmil
Crystal structure of the soluble part of cytochrome b6f complex iron-sulfur subunit from Thermosynechococcus elongatus BP-1
分子名称: Cytochrome b6-f complex iron-sulfur subunit, FE2/S2 (INORGANIC) CLUSTER
著者Veit, S, Takeda, K, Tsunoyama, Y, Roegner, M, Miki, K.
登録日2011-05-23
公開日2012-05-23
最終更新日2023-11-01
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Structure of a thermophilic cyanobacterial b(6)f-type Rieske protein
Acta Crystallogr.,Sect.D, 68, 2012
2XZE
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BU of 2xze by Molmil
Structural basis for AMSH-ESCRT-III CHMP3 interaction
分子名称: CHARGED MULTIVESICULAR BODY PROTEIN 3, STAM-BINDING PROTEIN
著者Solomons, J, Sabin, C, Weissenhorn, W.
登録日2010-11-25
公開日2011-08-24
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.75 Å)
主引用文献Structural Basis for Escrt-III Chmp3 Recruitment of Amsh.
Structure, 19, 2011
6FHP
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BU of 6fhp by Molmil
DAIP in complex with a C-terminal fragment of thermolysin
分子名称: Dispase autolysis-inducing protein, Thermolysin
著者Schmelz, S, Fiebig, D, Fuchsbauer, H.L, Blankenfeldt, W, Scrima, A.
登録日2018-01-15
公開日2018-09-12
最終更新日2024-01-17
実験手法X-RAY DIFFRACTION (1.703 Å)
主引用文献Destructive twisting of neutral metalloproteases: the catalysis mechanism of the Dispase autolysis-inducing protein from Streptomyces mobaraensis DSM 40487.
FEBS J., 285, 2018
2I5P
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BU of 2i5p by Molmil
Crystal structure of glyceraldehyde-3-phosphate dehydrogenase isoform 1 from K. marxianus
分子名称: BETA-MERCAPTOETHANOL, Glyceraldehyde-3-phosphate dehydrogenase 1, alpha-D-glucopyranose
著者Ferreira-da-Silva, F, Pereira, P.J.B, Gales, L, Moradas-Ferreira, P, Damas, A.M.
登録日2006-08-25
公開日2006-09-12
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献The Crystal and Solution Structures of Glyceraldehyde-3-phosphate Dehydrogenase Reveal Different Quaternary Structures.
J.Biol.Chem., 281, 2006
3M42
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BU of 3m42 by Molmil
Crystal structure of MAPKAP kinase 2 (MK2) complexed with a tetracyclic ATP site inhibitor
分子名称: 2-[5-(2-methoxyethoxy)pyridin-3-yl]-8,9,10,11-tetrahydro-7H-pyrido[3',4':4,5]pyrrolo[2,3-f]isoquinolin-7-one, MAGNESIUM ION, MAP kinase-activated protein kinase 2
著者Scheufler, C, Revesz, L, Be, C, Izaac, A, Huppertz, C, Schlapbach, A, Kroemer, M.
登録日2010-03-10
公開日2011-03-23
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.68 Å)
主引用文献Novel pyrrolo[2,3-f]isoquinoline based MAPKAP-K2 (MK2) inhibitors with potent in vitro and in vivo activity
To be Published
2W8C
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BU of 2w8c by Molmil
Plastocyanin variant with N-terminal Methionine - closed structure
分子名称: COPPER (II) ION, PLASTOCYANIN, ZINC ION
著者Crowley, P.B, Matias, P.M, Khan, A.R.
登録日2009-01-15
公開日2009-10-27
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Metal-Mediated Self-Assembly of a Beta-Sandwich Protein.
Chemistry, 15, 2009
2W88
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BU of 2w88 by Molmil
Plastocyanin variant with N-terminal Methionine - open structure
分子名称: COPPER (II) ION, PLASTOCYANIN, ZINC ION
著者Crowley, P.B, Matias, P.M, Khan, A.R.
登録日2009-01-14
公開日2009-10-27
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.89 Å)
主引用文献Metal-Mediated Self-Assembly of a Beta-Sandwich Protein.
Chemistry, 15, 2009
2OQR
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BU of 2oqr by Molmil
The structure of the response regulator RegX3 from Mycobacterium tuberculosis
分子名称: ACETATE ION, BETA-MERCAPTOETHANOL, LANTHANUM (III) ION, ...
著者King-Scott, J.
登録日2007-02-01
公開日2007-10-16
最終更新日2023-12-27
実験手法X-RAY DIFFRACTION (2.03 Å)
主引用文献The Structure of a Full-length Response Regulator from Mycobacterium tuberculosis in a Stabilized Three-dimensional Domain-swapped, Activated State.
J.Biol.Chem., 282, 2007
2L9M
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BU of 2l9m by Molmil
Structure of cIAP1 CARD
分子名称: Baculoviral IAP repeat-containing protein 2
著者Day, C.L, Rautureau, G.J.P, Hinds, M.G.
登録日2011-02-21
公開日2011-08-17
最終更新日2024-05-15
実験手法SOLUTION NMR
主引用文献CARD-mediated autoinhibition of cIAP1's E3 ligase activity suppresses cell proliferation and migration.
Mol.Cell, 42, 2011
4GJ7
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BU of 4gj7 by Molmil
Crystal structure of renin in complex with NVP-BCA079 (compound 12a)
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, N-{[(3S,4S)-4-benzylpyrrolidin-3-yl]methyl}-4-methoxy-3-(3-methoxypropoxy)-N-(propan-2-yl)benzamide, Renin, ...
著者Ostermann, N, Zink, F, Kroemer, M.
登録日2012-08-09
公開日2013-03-06
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献The Discovery of Novel Potent trans-3,4-Disubstituted Pyrrolidine Inhibitors of the Human Aspartic Protease Renin from in Silico Three-Dimensional (3D) Pharmacophore Searches.
J.Med.Chem., 56, 2013
3PJC
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BU of 3pjc by Molmil
Crystal structure of JAK3 complexed with a potent ATP site inhibitor showing high selectivity within the Janus kinase family
分子名称: 3-(1H-indol-3-yl)-4-[2-(4-oxopiperidin-1-yl)-5-(trifluoromethyl)pyrimidin-4-yl]-1H-pyrrole-2,5-dione, Tyrosine-protein kinase JAK3
著者Tavares, G.A, Thoma, G, Zerwes, H.-G, Kroemer, M.
登録日2010-11-09
公開日2010-12-29
最終更新日2024-02-21
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Identification of a Potent Janus Kinase 3 Inhibitor with High Selectivity within the Janus Kinase Family.
J.Med.Chem., 54, 2011
4GJ5
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BU of 4gj5 by Molmil
Crystal structure of renin in complex with NVP-AMQ838 (compound 5)
分子名称: (3R,4R)-3-(naphthalen-2-ylmethoxy)-4-phenylpiperidine, 2-acetamido-2-deoxy-beta-D-glucopyranose, Renin
著者Ostermann, N, Zink, F, Kroemer, M.
登録日2012-08-09
公開日2013-03-06
最終更新日2024-10-16
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献The Discovery of Novel Potent trans-3,4-Disubstituted Pyrrolidine Inhibitors of the Human Aspartic Protease Renin from in Silico Three-Dimensional (3D) Pharmacophore Searches.
J.Med.Chem., 56, 2013
4GJ6
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BU of 4gj6 by Molmil
Crystal structure of renin in complex with NVP-AYZ832 (compound 6a)
分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, N-{[(3S,4S)-4-benzylpyrrolidin-3-yl]methyl}-4-chloro-N-phenylaniline, Renin, ...
著者Ostermann, N, Zink, F, Kroemer, M.
登録日2012-08-09
公開日2013-03-06
最終更新日2023-09-13
実験手法X-RAY DIFFRACTION (2.58 Å)
主引用文献The Discovery of Novel Potent trans-3,4-Disubstituted Pyrrolidine Inhibitors of the Human Aspartic Protease Renin from in Silico Three-Dimensional (3D) Pharmacophore Searches.
J.Med.Chem., 56, 2013
3DLZ
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BU of 3dlz by Molmil
Crystal structure of human haspin in complex with AMP
分子名称: 1,2-ETHANEDIOL, ADENOSINE MONOPHOSPHATE, MAGNESIUM ION, ...
著者Filippakopoulos, P, Eswaran, J, Keates, T, Burgess-Brown, N, Murray, J.W, von Delft, F, Arrowsmith, C.H, Edwards, A.M, Wickstroem, M, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC)
登録日2008-06-30
公開日2008-07-15
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Structure and functional characterization of the atypical human kinase haspin.
Proc.Natl.Acad.Sci.USA, 106, 2009
3E0C
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BU of 3e0c by Molmil
Crystal Structure of DNA Damage-Binding protein 1(DDB1)
分子名称: DNA damage-binding protein 1
著者Amaya, M.F, Xu, L, Hao, H, Bountra, C, Wickstroem, M, Arrowsmith, C.H, Edwards, A.M, Bochkarev, A, Min, J, Structural Genomics Consortium (SGC)
登録日2008-07-31
公開日2008-09-16
最終更新日2024-10-30
実験手法X-RAY DIFFRACTION (2.41 Å)
主引用文献Structure and function of WD40 domain proteins.
Protein Cell, 2, 2011

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