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4U81
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BU of 4u81 by Molmil
MEK1 Kinase bound to small molecule inhibitor G659
分子名称: 8-[(4-cyclopropyl-2-fluorophenyl)amino]-N-(2-hydroxyethoxy)imidazo[1,5-a]pyridine-7-carboxamide, Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, ...
著者Robarge, K.D, Ultsch, M.H, Weismann, C.
登録日2014-07-31
公開日2014-09-24
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.701 Å)
主引用文献Structure based design of novel 6,5 heterobicyclic mitogen-activated protein kinase kinase (MEK) inhibitors leading to the discovery of imidazo[1,5-a] pyrazine G-479.
Bioorg.Med.Chem.Lett., 24, 2014
4U7Z
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BU of 4u7z by Molmil
Mitogen-Activated Protein Kinase Kinase (MEK1) bound to G805
分子名称: 5-[(4-bromo-2-chlorophenyl)amino]-4-fluoro-N-(2-hydroxyethoxy)-1-methyl-1H-benzimidazole-6-carboxamide, Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, ...
著者Robarge, K.D, Ultsch, M.H, Wiesmann, C.
登録日2014-07-31
公開日2014-09-24
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.805 Å)
主引用文献Structure based design of novel 6,5 heterobicyclic mitogen-activated protein kinase kinase (MEK) inhibitors leading to the discovery of imidazo[1,5-a] pyrazine G-479.
Bioorg.Med.Chem.Lett., 24, 2014
4U80
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BU of 4u80 by Molmil
MEK 1 kinase bound to G799
分子名称: 3-[(4-cyclopropyl-2-fluorophenyl)amino]-N-(2-hydroxyethoxy)furo[3,2-c]pyridine-2-carboxamide, Dual specificity mitogen-activated protein kinase kinase 1, MAGNESIUM ION, ...
著者Ultsch, M.H, Robarge, K.D, Weismann, C.
登録日2014-07-31
公開日2014-09-24
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structure based design of novel 6,5 heterobicyclic mitogen-activated protein kinase kinase (MEK) inhibitors leading to the discovery of imidazo[1,5-a] pyrazine G-479.
Bioorg.Med.Chem.Lett., 24, 2014
5IME
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BU of 5ime by Molmil
Crystal structure of P21-activated kinase 1 (PAK1) in complex with compound 9
分子名称: 8-(3-aminopropyl)-6-[2-chloro-4-(3-methyl-2-oxopyrazin-1(2H)-yl)phenyl]-2-(methylamino)pyrido[2,3-d]pyrimidin-7(8H)-one, Serine/threonine-protein kinase PAK 1
著者Li, D, Wang, W.
登録日2016-03-06
公開日2016-05-25
最終更新日2023-09-27
実験手法X-RAY DIFFRACTION (2.217 Å)
主引用文献Chemically Diverse Group I p21-Activated Kinase (PAK) Inhibitors Impart Acute Cardiovascular Toxicity with a Narrow Therapeutic Window.
J.Med.Chem., 59, 2016
1V3A
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BU of 1v3a by Molmil
Structure of human PRL-3, the phosphatase associated with cancer metastasis
分子名称: protein tyrosine phosphatase type IVA
著者Jeon, Y.H, Cheong, C.
登録日2003-10-30
公開日2004-10-30
最終更新日2023-12-27
実験手法SOLUTION NMR
主引用文献Structure of human PRL-3, the phosphatase associated with cancer metastasis
Febs Lett., 565, 2004
2WCU
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BU of 2wcu by Molmil
Crystal structure of mammalian FucU
分子名称: PROTEIN FUCU HOMOLOG, alpha-L-fucopyranose
著者Lee, K.-H, Kim, M.-S, Suh, H.-Y, Ku, B, Song, Y.-L, Oh, B.-H.
登録日2009-03-17
公開日2009-11-10
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Crystal Structures and Enzyme Mechanism of a Dual Fucose Mutarotase/Ribose Pyranase
J.Mol.Biol., 391, 2009
2P3T
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BU of 2p3t by Molmil
Crystal structure of human factor XA complexed with 3-Chloro-4-(2-methylamino-imidazol-1-ylmethyl)-thiophene-2-carboxylic acid [4-chloro-2-(5-chloro-pyridin-2-ylcarbamoyl)-6-methoxy-phenyl]-amide
分子名称: 3-CHLORO-4-(2-METHYLAMINO-IMIDAZOL-1-YLMETHYL)-THIOPHENE-2-CARBOXYLIC ACID [4-CHLORO-2-(5-CHLORO-PYRIDIN-2-YLCARBAMOYL)-6-METHOXY-PHENYL]-AMIDE, CALCIUM ION, CHLORIDE ION, ...
著者Adler, M, Whitlow, M.
登録日2007-03-09
公開日2008-01-22
最終更新日2023-08-30
実験手法X-RAY DIFFRACTION (1.92 Å)
主引用文献Thiophene-anthranilamides as highly potent and orally available factor xa inhibitors.
J.Med.Chem., 50, 2007
2QHB
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BU of 2qhb by Molmil
Crystal structure of NgTRF complexed with telomeric DNA
分子名称: 5'-D(P*CP*CP*CP*TP*AP*AP*A)-3', 5'-D(P*TP*TP*TP*AP*GP*GP*G)-3', Telomere binding protein TBP1
著者Cho, H.-S, Byun, J.-S, Jun, S.-H.
登録日2007-07-02
公開日2008-07-15
最終更新日2023-10-25
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Complex structure of plant telomere bindig protein, NgTRF and telomere DNA
To be Published
2CKX
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BU of 2ckx by Molmil
Crystal structure of NgTRF1, double-stranded telomeric repeat binding factor from Nicotiana tabacum.
分子名称: TELOMERE BINDING PROTEIN TBP1
著者Byun, J.-S, Cho, H.-S.
登録日2006-04-24
公開日2007-05-29
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structure of the DNA-Binding Domain of Ngtrf1 Reveals Unique Features of Plant Telomere-Binding Proteins.
Nucleic Acids Res., 36, 2008
1JDQ
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BU of 1jdq by Molmil
Solution Structure of TM006 Protein from Thermotoga maritima
分子名称: HYPOTHETICAL PROTEIN TM0983
著者Denisov, A.Y, Finak, G, Yee, A, Kozlov, G, Gehring, K, Arrowsmith, C.H.
登録日2001-06-14
公開日2002-02-27
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献An NMR approach to structural proteomics.
Proc.Natl.Acad.Sci.USA, 99, 2002
1JCU
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BU of 1jcu by Molmil
Solution Structure of MTH1692 Protein from Methanobacterium thermoautotrophicum
分子名称: conserved protein MTH1692
著者Kozlov, G, Ekiel, I, Gehring, K.
登録日2001-06-11
公開日2002-07-24
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献An NMR approach to structural proteomics.
Proc.Natl.Acad.Sci.USA, 99, 2002
1JRM
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BU of 1jrm by Molmil
NMR structure of MTH0637. Ontario Centre for Structural Proteomics target MTH0637_1_104; Northeast Structural Genomics Target TT135
分子名称: CONSERVED HYPOTHETICAL PROTEIN mth637
著者Pineda-Lucena, A, Northeast Structural Genomics Consortium (NESG)
登録日2001-08-14
公開日2002-02-27
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献An NMR approach to structural proteomics.
Proc.Natl.Acad.Sci.USA, 99, 2002
1JW2
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BU of 1jw2 by Molmil
SOLUTION STRUCTURE OF HEMOLYSIN EXPRESSION MODULATING PROTEIN Hha FROM ESCHERICHIA COLI. Ontario Centre for Structural Proteomics target EC0308_1_72; Northeast Structural Genomics Target ET88
分子名称: HEMOLYSIN EXPRESSION MODULATING PROTEIN Hha
著者Chang, X, Yee, A, Savchenko, A, Edwards, A.M, Arrowsmith, C.H, Northeast Structural Genomics Consortium (NESG)
登録日2001-09-02
公開日2002-02-27
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献An NMR approach to structural proteomics
Proc.Natl.Acad.Sci.USA, 99, 2002
1JW3
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BU of 1jw3 by Molmil
Solution Structure of Methanobacterium Thermoautotrophicum Protein 1598. Ontario Centre for Structural Proteomics target MTH1598_1_140; Northeast Structural Genomics Target TT6
分子名称: Conserved Hypothetical Protein MTH1598
著者Chang, X, Connelly, G, Yee, A, Kennedy, M.A, Edwards, A.M, Arrowsmith, C.H, Northeast Structural Genomics Consortium (NESG)
登録日2001-09-02
公開日2002-02-27
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献An NMR approach to structural proteomics.
Proc.Natl.Acad.Sci.USA, 99, 2002
1JE3
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BU of 1je3 by Molmil
Solution Structure of EC005 from Escherichia coli
分子名称: HYPOTHETICAL 8.6 KDA PROTEIN IN AMYA-FLIE INTERGENIC REGION
著者Yee, A, Gutierrez, P, Kozlov, G, Denisov, A, Gehring, K, Arrowsmith, C.
登録日2001-06-15
公開日2002-03-06
最終更新日2024-05-22
実験手法SOLUTION NMR
主引用文献An NMR approach to structural proteomics.
Proc.Natl.Acad.Sci.USA, 99, 2002
2PLN
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BU of 2pln by Molmil
Crystal structure analysis of HP1043, an orphan resonse regulator of h. pylori
分子名称: Response regulator
著者Lee, H.M, Kim, D.U, Byun, J.S, Cho, H.S.
登録日2007-04-20
公開日2007-05-01
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Crystal Structure Analysis of Hp1043, an Orphan Resonse Regulator of H. Pylori
To be Published
1OGF
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BU of 1ogf by Molmil
The Structure of Bacillus subtilis RbsD complexed with glycerol
分子名称: CHLORIDE ION, GLYCEROL, HIGH AFFINITY RIBOSE TRANSPORT PROTEIN RBSD
著者Kim, M.-S, Oh, B.-H.
登録日2003-04-30
公開日2003-09-01
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal Structures of Rbsd Leading to the Identification of Cytoplasmic Sugar-Binding Proteins with a Novel Folding Architecture
J.Biol.Chem., 278, 2003
1OGE
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BU of 1oge by Molmil
The Structure of Bacillus subtilis RbsD complexed with Ribose 5-phosphate
分子名称: 5-O-phosphono-beta-D-ribofuranose, CHLORIDE ION, HIGH AFFINITY RIBOSE TRANSPORT PROTEIN RBSD
著者Kim, M.-S, Oh, B.-H.
登録日2003-04-30
公開日2003-09-01
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2.05 Å)
主引用文献Crystal Structures of Rbsd Leading to the Identification of Cytoplasmic Sugar-Binding Proteins with a Novel Folding Architecture
J.Biol.Chem., 278, 2003
1OGC
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BU of 1ogc by Molmil
The Structure of Bacillus subtilis RbsD complexed with D-ribose
分子名称: CHLORIDE ION, HIGH AFFINITY RIBOSE TRANSPORT PROTEIN RBSD
著者Kim, M.-S, Oh, B.-H.
登録日2003-04-30
公開日2003-09-01
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (2 Å)
主引用文献Crystal Structures of Rbsd Leading to the Identification of Cytoplasmic Sugar-Binding Proteins with a Novel Folding Architecture
J.Biol.Chem., 278, 2003
1OGD
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BU of 1ogd by Molmil
The Structure of Bacillus subtilis RbsD complexed with D-ribose
分子名称: CHLORIDE ION, HIGH AFFINITY RIBOSE TRANSPORT PROTEIN RBSD, beta-D-ribopyranose
著者Kim, M.-S, Oh, B.-H.
登録日2003-04-30
公開日2003-09-01
最終更新日2024-05-08
実験手法X-RAY DIFFRACTION (1.95 Å)
主引用文献Crystal Structures of Rbsd Leading to the Identification of Cytoplasmic Sugar-Binding Proteins with a Novel Folding Architecture
J.Biol.Chem., 278, 2003
1YLA
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BU of 1yla by Molmil
Ubiquitin-conjugating enzyme E2-25 kDa (Huntington interacting protein 2)
分子名称: Ubiquitin-conjugating enzyme E2-25 kDa
著者Choe, J, Avvakumov, G.V, Newman, E.M, Mackenzie, F, Kozieradzki, I, Bochkarev, A, Sundstrom, M, Arrowsmith, C, Edwards, A, Dhe-paganon, S, Structural Genomics Consortium (SGC)
登録日2005-01-19
公開日2005-02-01
最終更新日2023-08-23
実験手法X-RAY DIFFRACTION (2.4 Å)
主引用文献Structural basis of E2-25K/UBB+1 interaction leading to proteasome inhibition and neurotoxicity
J.Biol.Chem., 285, 2010
1AYM
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BU of 1aym by Molmil
HUMAN RHINOVIRUS 16 COAT PROTEIN AT HIGH RESOLUTION
分子名称: HUMAN RHINOVIRUS 16 COAT PROTEIN, LAURIC ACID, MYRISTIC ACID, ...
著者Hadfield, A.T, Rossmann, M.G.
登録日1997-11-06
公開日1998-01-21
最終更新日2023-08-09
実験手法X-RAY DIFFRACTION (2.15 Å)
主引用文献The refined structure of human rhinovirus 16 at 2.15 A resolution: implications for the viral life cycle.
Structure, 5, 1997
6UYC
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BU of 6uyc by Molmil
Crystal structure of TEAD2 bound to Compound 2
分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, N-{5-[(E)-2-(4,4-difluorocyclohexyl)ethenyl]-6-methoxypyridin-3-yl}methanesulfonamide, Transcriptional enhancer factor TEF-4
著者Noland, C.L, Holden, J.K, Crawford, J.J, Zbieg, J.R, Cunningham, C.N.
登録日2019-11-12
公開日2020-06-24
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.658 Å)
主引用文献Small Molecule Dysregulation of TEAD Lipidation Induces a Dominant-Negative Inhibition of Hippo Pathway Signaling.
Cell Rep, 31, 2020
1QJG
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BU of 1qjg by Molmil
Crystal structure of delta5-3-ketosteroid isomerase from Pseudomonas testosteroni in complex with equilenin
分子名称: EQUILENIN, KETOSTEROID ISOMERASE, SULFATE ION
著者Cho, H.-S, Oh, B.-H.
登録日1999-06-24
公開日1999-11-16
最終更新日2023-12-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献Crystal Structure of Delta-5-3-Ketosteroid Isomerase from Pseudomonas Testosteroni in Complex with Equilenin Settles the Correct Hydrogen Scheme for Transition-State Stabilization
J.Biol.Chem., 274, 1999
6UYB
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BU of 6uyb by Molmil
Crystal structure of TEAD2 bound to Compound 1
分子名称: (3R,4R)-1-{3-[(E)-2-(4-chlorophenyl)ethenyl]-4-methoxy-5-methylphenyl}-3,4-dihydroxypyrrolidin-2-one, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, GLYCEROL, ...
著者Noland, C.L, Holden, J.K, Crawford, J.J, Zbieg, J.R, Cunningham, C.N.
登録日2019-11-12
公開日2020-06-24
最終更新日2023-10-11
実験手法X-RAY DIFFRACTION (1.543 Å)
主引用文献Small Molecule Dysregulation of TEAD Lipidation Induces a Dominant-Negative Inhibition of Hippo Pathway Signaling.
Cell Rep, 31, 2020

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