Author results

2AYR
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A SERM DESIGNED FOR THE TREATMENT OF UTERINE LEIOMYOMA WITH UNIQUE TISSUE SPECIFICITY FOR UTERUS AND OVARIES IN RATS
Descriptor:Estrogen receptor, 6-(4-METHYLSULFONYL-PHENYL)-5-[4-(2-PIPERIDIN-1-YLETHOXY)PHENOXY]NAPHTHALEN-2-OL
Authors:Hummel, C.W., Geiser, A.G., Bryant, H.U., Cohen, I.R., Dally, R.D., Fong, K.C., Frank, S.A., Hinklin, R., Jones, S.A., Lewis, G., McCann, D.J., Shepherd, T.A., Tian, H., Rudman, D.G., Wallace, O.B., Wang, Y., Dodge, J.A.
Deposit date:2005-09-07
Release date:2005-11-22
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (1.9 Å)
Cite:A selective estrogen receptor modulator designed for the treatment of uterine leiomyoma with unique tissue specificity for uterus and ovaries in rats
J.Med.Chem., 48, 2005
1NDE
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ESTROGEN RECEPTOR BETA WITH SELECTIVE TRIAZINE MODULATOR
Descriptor:Estrogen receptor beta, 4-(2-{[4-{[3-(4-CHLOROPHENYL)PROPYL]SULFANYL}-6-(1-PIPERAZINYL)-1,3,5-TRIAZIN-2-YL]AMINO}ETHYL)PHENOL
Authors:Henke, B.R., Consler, T.G., Go, N., Hale, R.L., Hohman, D.R., Jones, S.A., Lu, A.T., Moore, L.B., Moore, J.T., Orband-Miller, L.A., Robinett, R.G., Shearin, J., Spearing, P.K., Stewart, E.L., Turnbull, P.S., Weaver, S.L., Williams, S.P., Wisely, G.B., Lambert, M.H.
Deposit date:2002-12-09
Release date:2002-12-18
Last modified:2017-10-11
Method:X-RAY DIFFRACTION (3 Å)
Cite:A New Series of Estrogen Receptor Modulators That Display Selectivity for Estrogen Receptor beta
J.Med.Chem., 45, 2002
2POG
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BENZOPYRANS AS SELECTIVE ESTROGEN RECEPTOR B AGONISTS (SERBAS). PART 2: STRUCTURE ACTIVITY RELATIONSHIP STUDIES ON THE BENZOPYRAN SCAFFOLD.
Descriptor:Estrogen receptor, (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-9-OL
Authors:Richardson, T.I., Norman, B.H., Lugar, C.W., Jones, S.A., Wang, Y., Durbin, J.D., Krishnan, V., Dodge, J.A.
Deposit date:2007-04-26
Release date:2007-09-11
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (1.84 Å)
Cite:Benzopyrans as selective estrogen receptor beta agonists (SERBAs). Part 2: structure-activity relationship studies on the benzopyran scaffold.
Bioorg.Med.Chem.Lett., 17, 2007
4A5Q
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CRYSTAL STRUCTURE OF THE CHITINASE CHI1 FITTED INTO THE 3D STRUCTURE OF THE YERSINIA ENTOMOPHAGA TOXIN COMPLEX
Descriptor:CHI1
Authors:Busby, J.N., Landsberg, M.J., Simpson, R.M., Jones, S.A., Hankamer, B., Hurst, M.R.H., Lott, J.S.
Deposit date:2011-10-27
Release date:2011-11-16
Last modified:2017-08-23
Method:ELECTRON MICROSCOPY (17 Å)
Cite:Structural Analysis of Chi1 Chitinase from Yen-Tc: The Multisubunit Insecticidal Abc Toxin Complex of Yersinia Entomophaga.
J.Mol.Biol., 415, 2012
5CUQ
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IDENTIFICATION AND CHARACTERIZATION OF NOVEL BROAD SPECTRUM INHIBITORS OF THE FLAVIVIRUS METHYLTRANSFERASE
Descriptor:Nonstructural protein NS5, N,N'-BIS(4-AMINO-2-METHYLQUINOLIN-6-YL)UREA
Authors:Brecher, B., Chen, H., Li, Z., Banavali, N.K., Jones, S.A., Zhang, J., Kramer, L.D., Li, H.M.
Deposit date:2015-07-24
Release date:2016-02-03
Last modified:2017-09-27
Method:X-RAY DIFFRACTION (1.696 Å)
Cite:Identification and Characterization of Novel Broad-Spectrum Inhibitors of the Flavivirus Methyltransferase.
Acs Infect Dis., 1, 2015
1W4S
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CRYSTAL STRUCTURE OF THE PROXIMAL BAH DOMAIN OF POLYBROMO
Descriptor:POLYBROMO 1 PROTEIN, CHLORIDE ION
Authors:Oliver, A.W., Roe, S.M., Pearl, L.H.
Deposit date:2004-07-28
Release date:2005-04-27
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (1.55 Å)
Cite:Crystal Structure of the Proximal Bah Domain of the Polybromo Protein
Biochem.J., 389, 2005
2I0G
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BENZOPYRANS ARE SELECTIVE ESTROGEN RECEPTOR BETA AGONISTS (SERBAS) WITH NOVEL ACTIVITY IN MODELS OF BENIGN PROSTATIC HYPERPLASIA
Descriptor:Estrogen receptor beta, (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL
Authors:Wang, Y.
Deposit date:2006-08-10
Release date:2006-10-24
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Benzopyrans are selective estrogen receptor Beta agonists with novel activity in models of benign prostatic hyperplasia.
J.Med.Chem., 49, 2006
2I0J
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BENZOPYRANS ARE SELECTIVE ESTROGEN RECEPTOR BETA AGONISTS (SERBAS) WITH NOVEL ACTIVITY IN MODELS OF BENIGN PROSTATIC HYPERPLASIA
Descriptor:Estrogen receptor alpha, (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL
Authors:Wang, Y.
Deposit date:2006-08-10
Release date:2006-10-24
Last modified:2017-10-18
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Benzopyrans are selective estrogen receptor Beta agonists with novel activity in models of benign prostatic hyperplasia.
J.Med.Chem., 49, 2006
2IZO
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STRUCTURE OF AN ARCHAEAL PCNA1-PCNA2-FEN1 COMPLEX
Descriptor:FLAP STRUCTURE-SPECIFIC ENDONUCLEASE, DNA POLYMERASE SLIDING CLAMP C, DNA POLYMERASE SLIDING CLAMP B, ...
Authors:Dore, A.S., Kilkenny, M.L., Roe, S.M., Pearl, L.H.
Deposit date:2006-07-25
Release date:2006-09-06
Last modified:2011-07-13
Method:X-RAY DIFFRACTION (2.9 Å)
Cite:Structure of an Archaeal PCNA1-PCNA2-Fen1 Complex: Elucidating PCNA Subunit and Client Enzyme Specificity.
Nucleic Acids Res., 34, 2006
3DCT
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FXR WITH SRC1 AND GW4064
Descriptor:Bile acid receptor, Nuclear receptor coactivator 1, 3-[(E)-2-(2-chloro-4-{[3-(2,6-dichlorophenyl)-5-(1-methylethyl)isoxazol-4-yl]methoxy}phenyl)ethenyl]benzoic acid
Authors:Williams, S.P., Madauss, K.P.
Deposit date:2008-06-04
Release date:2008-08-12
Last modified:2017-10-25
Method:X-RAY DIFFRACTION (2.5 Å)
Cite:Conformationally constrained farnesoid X receptor (FXR) agonists: Naphthoic acid-based analogs of GW 4064.
Bioorg.Med.Chem.Lett., 18, 2008
3DCU
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FXR WITH SRC1 AND GSK8062
Descriptor:Bile acid receptor, Nuclear receptor coactivator 1, 6-(4-{[3-(2,6-dichlorophenyl)-5-(1-methylethyl)isoxazol-4-yl]methoxy}phenyl)naphthalene-1-carboxylic acid
Authors:Williams, S.P., Madauss, K.P.
Deposit date:2008-06-04
Release date:2008-08-12
Last modified:2017-10-25
Method:X-RAY DIFFRACTION (2.95 Å)
Cite:Conformationally constrained farnesoid X receptor (FXR) agonists: Naphthoic acid-based analogs of GW 4064.
Bioorg.Med.Chem.Lett., 18, 2008
3OA5
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THE STRUCTURE OF CHI1, A CHITINASE FROM YERSINIA ENTOMOPHAGA
Descriptor:Chi1, NONAETHYLENE GLYCOL, GLYCEROL
Authors:Busby, J.N., Lott, J.S., Hurst, M.R.H.
Deposit date:2010-08-04
Release date:2011-08-10
Last modified:2013-06-19
Method:X-RAY DIFFRACTION (1.74 Å)
Cite:Structural analysis of Chi1 Chitinase from Yen-Tc: the multisubunit insecticidal ABC toxin complex of Yersinia entomophaga
J.Mol.Biol., 415, 2012
5BQG
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CRYSTAL STRUCTURE OF MPGES-1 BOUND TO AN INHIBITOR
Descriptor:Prostaglandin E synthase, 2-chloro-N-(4-phenyl-1,3-thiazol-2-yl)benzamide, GLUTATHIONE, ...
Authors:Fisher, M.J., Schiffler, M.A., Kuklish, S.L., Antonysamy, S., Luz, J.G.
Deposit date:2015-05-29
Release date:2016-04-13
Method:X-RAY DIFFRACTION (1.436 Å)
Cite:Discovery and Characterization of 2-Acylaminoimidazole Microsomal Prostaglandin E Synthase-1 Inhibitors.
J.Med.Chem., 59, 2016
5BQH
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DISCOVERY OF A POTENT AND SELECTIVE MPGES-1 INHIBITOR FOR THE TREATMENT OF PAIN
Descriptor:Prostaglandin E synthase, N-[4-(4-chlorophenyl)-1H-imidazol-2-yl]-2-(difluoromethyl)-5-{[(2-methylpropanoyl)amino]methyl}benzamide, GLUTATHIONE, ...
Authors:Fisher, M.J., Schiffler, M.A., Kuklish, S.L., Antonysamy, S., Luz, J.G.
Deposit date:2015-05-29
Release date:2016-04-13
Method:X-RAY DIFFRACTION (1.601 Å)
Cite:Discovery and Characterization of 2-Acylaminoimidazole Microsomal Prostaglandin E Synthase-1 Inhibitors.
J.Med.Chem., 59, 2016
5BQI
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DISCOVERY OF A POTENT AND SELECTIVE MPGES-1 INHIBITOR FOR THE TREATMENT OF PAIN
Descriptor:Prostaglandin E synthase, 2-(difluoromethyl)-5-{[(2-methylpropanoyl)amino]methyl}-N-{5-methyl-4-[4-(trifluoromethyl)phenyl]-1H-imidazol-2-yl}pyridine-3-carboxamide, GLUTATHIONE, ...
Authors:Fisher, M.J., Schiffler, M.A., Kuklish, S.L., Antonysamy, S., Luz, J.G.
Deposit date:2015-05-29
Release date:2016-04-13
Method:X-RAY DIFFRACTION (1.88 Å)
Cite:Discovery and Characterization of 2-Acylaminoimidazole Microsomal Prostaglandin E Synthase-1 Inhibitors.
J.Med.Chem., 59, 2016
5K13
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CRYSTAL STRUCTURE OF THE RAR ALPHA LIGAND-BINDING DOMAIN IN COMPLEX WITH AN ANTAGONIST
Descriptor:Retinoic acid receptor alpha, 4-{5-(3-tert-butylphenyl)-1-[4-(methylsulfonyl)phenyl]-1H-pyrazol-3-yl}benzoic acid
Authors:Wang, Y., Stout, S.L.
Deposit date:2016-05-17
Release date:2016-06-22
Method:X-RAY DIFFRACTION (1.85 Å)
Cite: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
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