Author results

2MG8
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SOLUTION STRUCTURE OF TFF1 ESTROGEN RESPONSE ELEMENT COMPLEXED WITH DNA BIS-INTERCALATING ANTICANCER DRUG XR5944 (MLN944)
分子名称:5'-D(*AP*GP*GP*TP*CP*AP*CP*GP*GP*TP*GP*GP*CP*CP*A)-3', 5'-D(*TP*GP*GP*CP*CP*AP*CP*CP*GP*TP*GP*AP*CP*CP*T)-3', 1-METHYL-9-[12-(9-METHYLPHENAZIN-10-IUM-1-YL)-12-OXO-2,11-DIAZA-5,8-DIAZONIADODEC-1-ANOYL]PHENAZIN-10-IUM
著者Lin, C.
登録日2013-10-30
公開日2014-04-23
最終更新日2014-09-17
実験手法SOLUTION NMR
主引用文献Solution structure of a 2:1 complex of anticancer drug XR5944 with TFF1 estrogen response element: insights into DNA recognition by a bis-intercalator.
Nucleic Acids Res., 42, 2014
6CCW
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HYBRID-2 FORM HUMAN TELOMERIC G QUADRUPLEX IN COMPLEX WITH EPIBERBERINE
分子名称:DNA (26-MER), Epiberberine
著者Lin, C., Yang, D.Z.
登録日2018-02-07
公開日2018-06-20
最終更新日2018-10-17
実験手法SOLUTION NMR
主引用文献Molecular Recognition of the Hybrid-2 Human Telomeric G-Quadruplex by Epiberberine: Insights into Conversion of Telomeric G-Quadruplex Structures.
Angew. Chem. Int. Ed. Engl., 57, 2018
1A1R
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HCV NS3 PROTEASE DOMAIN:NS4A PEPTIDE COMPLEX
分子名称:NS3 PROTEIN, NS4A PROTEIN, ZINC ION
著者Kim, J.L., Morgenstern, K.A., Lin, C., Fox, T., Dwyer, M.D., Landro, J.A., Chambers, S.P., Markland, W., Lepre, C.A., O'Malley, E.T., Harbeson, S.L., Rice, C.M., Murcko, M.A., Caron, P.R., Thomson, J.A.
登録日1997-12-15
公開日1998-06-17
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Crystal structure of the hepatitis C virus NS3 protease domain complexed with a synthetic NS4A cofactor peptide.
Cell(Cambridge,Mass.), 87, 1996
1A1V
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HEPATITIS C VIRUS NS3 HELICASE DOMAIN COMPLEXED WITH SINGLE STRANDED SDNA
分子名称:DNA (5'-D(*UP*UP*UP*UP*UP*UP*UP*U)-3'), PROTEIN (NS3 PROTEIN), SULFATE ION
著者Kim, J.L., Morgenstern, K.A., Griffith, J.P., Dwyer, M.D., Thomson, J.A., Murcko, M.A., Lin, C., Caron, P.R.
登録日1997-12-17
公開日1999-01-13
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Hepatitis C virus NS3 RNA helicase domain with a bound oligonucleotide: the crystal structure provides insights into the mode of unwinding.
Structure, 6, 1998
1Y9H
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METHYLATION OF CYTOSINE AT C5 IN A CPG SEQUENCE CONTEXT CAUSES A CONFORMATIONAL SWITCH OF A BENZO[A]PYRENE DIOL EPOXIDE-N2-GUANINE ADDUCT IN DNA FROM A MINOR GROOVE ALIGNMENT TO INTERCALATION WITH BASE DISPLACEMENT
分子名称:5'-D(*CP*CP*AP*TP*(5CM)P*(BPG)P*CP*TP*AP*CP*C)-3', 5'-D(*GP*GP*TP*AP*GP*CP*GP*AP*TP*GP*G)-3', 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE
著者Zhang, N., Lin, C., Huang, X., Kolbanovskiy, A., Hingerty, B.E., Amin, S., Broyde, S., Geacintov, N.E., Patel, D.J.
登録日2004-12-15
公開日2005-03-22
最終更新日2011-07-13
実験手法SOLUTION NMR
主引用文献Methylation of cytosine at C5 in a CpG sequence context causes a conformational switch of a benzo[a]pyrene diol epoxide-N2-guanine adduct in DNA from a minor groove alignment to intercalation with base displacement.
J.Mol.Biol., 346, 2005
3T8S
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APO AND INSP3-BOUND CRYSTAL STRUCTURES OF THE LIGAND-BINDING DOMAIN OF AN INSP3 RECEPTOR
分子名称:Inositol 1,4,5-trisphosphate receptor type 1, D-MYO-INOSITOL-1,4,5-TRIPHOSPHATE
著者Lin, C., Baek, K., Lu, Z.
登録日2011-08-01
公開日2011-09-07
最終更新日2011-10-26
実験手法X-RAY DIFFRACTION (3.77 Å)
主引用文献Apo and InsP(3)-bound crystal structures of the ligand-binding domain of an InsP(3) receptor.
Nat.Struct.Mol.Biol., 18, 2011
2RIM
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CRYSTAL STRUCTURE OF RTT109
分子名称:Regulator of Ty1 transposition protein 109
著者Yuan, Y.A.
登録日2007-10-12
公開日2008-09-02
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Structural insights into histone h3 lysine 56 acetylation by rtt109
Structure, 16, 2008
2ZFN
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SELF-ACETYLATION MEDIATED HISTONE H3 LYSINE 56 ACETYLATION BY RTT109
分子名称:Regulator of Ty1 transposition protein 109, ACETYL COENZYME *A, GLYCEROL
著者Yuan, Y.A.
登録日2008-01-08
公開日2008-09-23
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Structural insights into histone h3 lysine 56 acetylation by rtt109
Structure, 16, 2008
4IGU
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CRYSTAL STRUCTURE OF THE RGS DOMAIN OF CG5036
分子名称:CG5036, CHLORIDE ION, SODIUM ION, ...
著者Gabdulkhakov, A., Tishchenko, S.
登録日2012-12-18
公開日2013-12-18
最終更新日2014-05-21
実験手法X-RAY DIFFRACTION (1.9 Å)
主引用文献Double suppression of the G alpha protein activity by RGS proteins
Mol.Cell, 53, 2014
4CLC
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CRYSTAL STRUCTURE OF YBR137W PROTEIN
分子名称:UPF0303 PROTEIN YBR137W
著者Yeh, Y.-H., Lin, T.-W., Lin, C.-Y., Hsiao, C.-D.
登録日2014-01-14
公開日2014-11-19
最終更新日2019-10-16
実験手法X-RAY DIFFRACTION (2.8 Å)
主引用文献Structural and Functional Characterization of Ybr137Wp Implicate its Involvement in the Targeting of Tail-Anchored Proteins to Membranes.
Mol.Cell.Biol., 34, 2014
2P59
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CRYSTAL STRUCTURE OF HEPATITIS C VIRUS NS3.4A PROTEASE
分子名称:NS3, peptide, (2S,3AS,7AS)-1-[(2S)-2-{[(2S)-2-CYCLOHEXYL-2-({[(2R)-4-NITRO-2H-PYRROL-2-YL]CARBONYL}AMINO)ACETYL]AMINO}-3,3-DIMETHYLBUTANOYL]-N-{(1S)-1-[(1R)-2-(CYCLOPROPYLAMINO)-1-HYDROXY-2-OXOETHYL]BUTYL}OCTAHYDRO-1H-INDOLE-2-CARBOXAMIDE
著者Perni, R.B., Wei, Y.
登録日2007-03-14
公開日2008-02-05
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.9 Å)
主引用文献Inhibitors of hepatitis C virus NS3.4A protease. Effect of P4 capping groups on inhibitory potency and pharmacokinetics.
Bioorg.Med.Chem.Lett., 17, 2007
3EGA
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CRYSTAL STRUCTURE OF PELLINO2 FHA DOMAIN AT 1.8 ANGSTROMS RESOLUTION
分子名称:Protein pellino homolog 2, SULFATE ION
著者Ferguson, K.M., Lin, C., Schmitz, K.R.
登録日2008-09-10
公開日2008-12-23
最終更新日2017-10-25
実験手法X-RAY DIFFRACTION (1.8 Å)
主引用文献Pellino proteins contain a cryptic FHA domain that mediates interaction with phosphorylated IRAK1.
Structure, 16, 2008
3EGB
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STRUCTURE OF PELLINO2 FHA DOMAIN AT 3.3 ANGSTROMS RESOLUTION.
分子名称:Protein pellino homolog 2
著者Ferguson, K.M., Lin, C., Schmitz, K.R.
登録日2008-09-10
公開日2008-12-23
最終更新日2017-10-25
実験手法X-RAY DIFFRACTION (3.25 Å)
主引用文献Pellino proteins contain a cryptic FHA domain that mediates interaction with phosphorylated IRAK1.
Structure, 16, 2008
1BT7
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THE SOLUTION NMR STRUCTURE OF THE N-TERMINAL PROTEASE DOMAIN OF THE HEPATITIS C VIRUS (HCV) NS3-PROTEIN, FROM BK STRAIN, 20 STRUCTURES
分子名称:NS3 SERINE PROTEASE, ZINC ION
著者Barbato, G., Cicero, D.O., Nardi, M.C., Steinkuhler, C., Cortese, R., De Francesco, R., Bazzo, R.
登録日1998-09-01
公開日1999-06-22
最終更新日2011-07-13
実験手法SOLUTION NMR
主引用文献The solution structure of the N-terminal proteinase domain of the hepatitis C virus (HCV) NS3 protein provides new insights into its activation and catalytic mechanism.
J.Mol.Biol., 289, 1999
4WK7
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CRYSTAL STRUCTURE OF HUMAN ADAMTS-4 IN COMPLEX WITH INHIBITOR (COMPOUND 1, 2-(4-CHLOROPHENOXY)-N-{[(4R)-4-METHYL-2,5-DIOXOIMIDAZOLIDIN-4-YL]METHYL} ACETAMIDE)
分子名称:A disintegrin and metalloproteinase with thrombospondin motifs 4, ZINC ION, CALCIUM ION, ...
著者Durbin, J.D., Stout, S.L.
登録日2014-10-01
公開日2014-12-10
最終更新日2017-09-27
実験手法X-RAY DIFFRACTION (1.24 Å)
主引用文献Identification of potent and selective hydantoin inhibitors of aggrecanase-1 and aggrecanase-2 that are efficacious in both chemical and surgical models of osteoarthritis.
J.Med.Chem., 57, 2014
4WKE
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CRYSTAL STRUCTURE OF HUMAN ADAMTS-4 IN COMPLEX WITH INHIBITOR 5-CHLORO-N-{[(4R)-2,5-DIOXO-4-(1,3-THIAZOL-2-YL)IMIDAZOLIDIN-4-YL]METHYL}-1-BENZOFURAN-2-CARBOXAMIDE (COMPOUND 10)
分子名称:A disintegrin and metalloproteinase with thrombospondin motifs 4, ZINC ION, CALCIUM ION, ...
著者Durbin, J.D.
登録日2014-10-02
公開日2014-12-10
最終更新日2015-02-04
実験手法X-RAY DIFFRACTION (1.62 Å)
主引用文献Identification of potent and selective hydantoin inhibitors of aggrecanase-1 and aggrecanase-2 that are efficacious in both chemical and surgical models of osteoarthritis.
J.Med.Chem., 57, 2014
4WKI
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CRYSTAL STRUCTURE OF HUMAN ADAMTS-4 IN COMPLEX WITH INHIBITOR 5-CHLORO-N-{[(4S)-4-(1-METHYL-1H-IMIDAZOL-2-YL)-2,5-DIOXOIMIDAZOLIDIN-4-YL]METHYL}-1-BENZOFURAN-2-CARBOXAMIDE (COMPOUND 11)
分子名称:A disintegrin and metalloproteinase with thrombospondin motifs 4, ZINC ION, CALCIUM ION, ...
著者Durbin, J.D.
登録日2014-10-02
公開日2014-12-10
最終更新日2015-02-04
実験手法X-RAY DIFFRACTION (1.6 Å)
主引用文献Identification of potent and selective hydantoin inhibitors of aggrecanase-1 and aggrecanase-2 that are efficacious in both chemical and surgical models of osteoarthritis.
J.Med.Chem., 57, 2014
5OEL
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MYCOBACTERIUM TUBERCULOSIS DPRE1 MUTANT Y314C IN COMPLEX WITH TCA1
分子名称:Decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, ethyl ({2-[(1,3-benzothiazol-2-ylcarbonyl)amino]thiophen-3-yl}carbonyl)carbamate
著者Futterer, K., Batt, S.M., Besra, G.S.
登録日2017-07-08
公開日2018-05-16
実験手法X-RAY DIFFRACTION (2.2 Å)
主引用文献Determinants of the Inhibition of DprE1 and CYP2C9 by Antitubercular Thiophenes.
Angew. Chem. Int. Ed. Engl., 56, 2017
5OEP
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MYCOBACTERIUM TUBERCULOSIS DPRE1 IN COMPLEX WITH INHIBITOR TCA481
分子名称:Decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, ethyl ~{N}-[2-(1,3-benzothiazol-2-ylcarbonylamino)-5-fluoranyl-thiophen-3-yl]carbonylcarbamate, ...
著者Futterer, K., Batt, S.M., Besra, G.S.
登録日2017-07-09
公開日2018-05-16
実験手法X-RAY DIFFRACTION (2.35 Å)
主引用文献Determinants of the Inhibition of DprE1 and CYP2C9 by Antitubercular Thiophenes.
Angew. Chem. Int. Ed. Engl., 56, 2017
5OEQ
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MYCOBACTERIUM TUBERCULOSIS DPRE1 IN COMPLEX WITH INHIBITOR TCA020
分子名称:Decaprenylphosphoryl-beta-D-ribose oxidase, FLAVIN-ADENINE DINUCLEOTIDE, ~{N}-[3-(pyrimidin-2-ylcarbamoyl)thiophen-2-yl]-[1,3]thiazolo[4,5-c]pyridine-2-carboxamide, ...
著者Futterer, K., Batt, S.M., Besra, G.S.
登録日2017-07-09
公開日2018-05-16
実験手法X-RAY DIFFRACTION (2.25 Å)
主引用文献Determinants of the Inhibition of DprE1 and CYP2C9 by Antitubercular Thiophenes.
Angew. Chem. Int. Ed. Engl., 56, 2017
5W0C
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CYTOCHROME P450 (CYP) 2C9 TCA007 INHIBITOR COMPLEX
分子名称:Cytochrome P450 2C9, PROTOPORPHYRIN IX CONTAINING FE, ethyl {2-[([1,3]thiazolo[4,5-c]pyridine-2-carbonyl)amino]thiophene-3-carbonyl}carbamate, ...
著者Johnson, E.F., Hsu, M.-H.
登録日2017-05-30
公開日2017-09-13
最終更新日2017-10-18
実験手法X-RAY DIFFRACTION (2.001 Å)
主引用文献Determinants of the Inhibition of DprE1 and CYP2C9 by Antitubercular Thiophenes.
Angew. Chem. Int. Ed. Engl., 56, 2017
1SO8
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ABETA-BOUND HUMAN ABAD STRUCTURE [ALSO KNOWN AS 3-HYDROXYACYL-COA DEHYDROGENASE TYPE II (TYPE II HADH), ENDOPLASMIC RETICULUM-ASSOCIATED AMYLOID BETA-PEPTIDE BINDING PROTEIN (ERAB)]
分子名称:3-hydroxyacyl-CoA dehydrogenase type II, SODIUM ION, CHLORIDE ION
著者Lustbader, J.W., Cirilli, M., Wu, H.
登録日2004-03-13
公開日2004-05-11
最終更新日2011-07-13
実験手法X-RAY DIFFRACTION (2.3 Å)
主引用文献ABAD directly links Abeta to mitochondrial toxicity in Alzheimer's disease.
Science, 304, 2004
4GL2
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STRUCTURAL BASIS FOR DSRNA DUPLEX BACKBONE RECOGNITION BY MDA5
分子名称:Interferon-induced helicase C domain-containing protein 1, RNA (5'-R(*AP*UP*CP*CP*GP*CP*GP*GP*CP*CP*CP*U)-3'), RNA (5'-R(P*AP*GP*GP*GP*CP*CP*GP*CP*GP*GP*AP*U)-3'), ...
著者Wu, B., Hur, S.
登録日2012-08-13
公開日2013-01-09
最終更新日2013-02-06
実験手法X-RAY DIFFRACTION (3.557 Å)
主引用文献Structural Basis for dsRNA Recognition, Filament Formation, and Antiviral Signal Activation by MDA5.
Cell(Cambridge,Mass.), 152, 2013
5K13
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CRYSTAL STRUCTURE OF THE RAR ALPHA LIGAND-BINDING DOMAIN IN COMPLEX WITH AN ANTAGONIST
分子名称:Retinoic acid receptor alpha, 4-{5-(3-tert-butylphenyl)-1-[4-(methylsulfonyl)phenyl]-1H-pyrazol-3-yl}benzoic acid
著者Wang, Y., Stout, S.L.
登録日2016-05-17
公開日2016-06-22
実験手法X-RAY DIFFRACTION (1.85 Å)
主引用文献Identification of potent and selective retinoic acid receptor gamma (RAR gamma ) antagonists for the treatment of osteoarthritis pain using structure based drug design.
Bioorg.Med.Chem.Lett., 26, 2016
2OIN
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CRYSTAL STRUCTURE OF HCV NS3-4A R155K MUNTANT
分子名称:Polyprotein, NS4A peptide, ZINC ION
著者Wei, Y.
登録日2007-01-11
公開日2007-06-05
最終更新日2017-10-18
実験手法X-RAY DIFFRACTION (2.5 Å)
主引用文献Phenotypic and structural analyses of hepatitis C virus NS3 protease Arg155 variants: sensitivity to telaprevir (VX-950) and interferon alpha.
J.Biol.Chem., 282, 2007
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