PDB: 1801 resultsInfo pagesStatus searchChemie searchBIRD

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2Q5S	Crystal Structure of PPARgamma bound to partial agonist nTZDpa Descriptor: 5-CHLORO-1-(4-CHLOROBENZYL)-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID, Peroxisome Proliferator-Activated Receptor gamma Authors: Bruning, J.B, Nettles, K.W. Deposit date: 2007-06-01 Release date: 2007-10-23 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.05 Å) Cite: Partial Agonists Activate PPARgamma Using a Helix 12 Independent Mechanism Structure, 15, 2007
2Q61	Crystal Structure of PPARgamma ligand binding domain bound to partial agonist SR145 Descriptor: 1-BENZYL-5-CHLORO-3-(PHENYLTHIO)-1H-INDOLE-2-CARBOXYLIC ACID, Peroxisome Proliferator-Activated Receptor gamma Authors: Bruning, J.B, Nettles, K.W. Deposit date: 2007-06-04 Release date: 2007-10-23 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.197 Å) Cite: Partial Agonists Activate PPARgamma Using a Helix 12 Independent Mechanism Structure, 15, 2007
2Q60	Crystal structure of the ligand binding domain of polyandrocarpa misakiensis rxr in tetramer in absence of ligand Descriptor: Retinoid X receptor Authors: Borel, F, De Groot, A, Juillan-Binard, C, De Rosny, E, Laudet, V, Pebay-Peyroula, E, Fontecilla-Camps, J.-C, Ferrer, J.-L. Deposit date: 2007-06-04 Release date: 2008-05-27 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Crystal structure of the ligand-binding domain of the retinoid X receptor from the ascidian polyandrocarpa misakiensis. Proteins, 74, 2008
2Q6J	Crystal Structure of Estrogen Receptor alpha Complexed to a B-N Substituted Ligand Descriptor: 4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL, Estrogen receptor, GRIP peptide Authors: Zhou, H, Nettles, K.W, Bruning, J.B, Kim, Y, Joachimiak, A, Sharma, S, Carlson, K.E, Stossi, F, Katzenellenbogen, B.S, Greene, G.L, Katzenellenbogen, J.A. Deposit date: 2007-06-05 Release date: 2007-06-26 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Elemental isomerism: a boron-nitrogen surrogate for a carbon-carbon double bond increases the chemical diversity of estrogen receptor ligands Chem.Biol., 14, 2007
2Q70	Estrogen receptor alpha ligand-binding domain complxed to a benzopyran ligand Descriptor: (3AS,4R,9BR)-2,2-DIFLUORO-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL, Estrogen receptor Authors: Wang, Y. Deposit date: 2007-06-05 Release date: 2007-08-07 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.95 Å) Cite: Benzopyrans as selective estrogen receptor beta agonists (SERBAs). Part 3: synthesis of cyclopentanone and cyclohexanone intermediates for C-ring modification. Bioorg.Med.Chem.Lett., 17, 2007
2Q7I	The Wild Type Androgen Receptor Ligand Binding Domain Bound with Testosterone and an AR 20-30 Peptide Descriptor: Androgen receptor, GLYCEROL, SULFATE ION, ... Authors: Gampe, R.T. Deposit date: 2007-06-06 Release date: 2007-07-24 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.87 Å) Cite: Modulation of androgen receptor activation function 2 by testosterone and dihydrotestosterone. J.Biol.Chem., 282, 2007
2Q7K	The Androgen Receptor Prostate Cancer Mutant H874Y Ligand Binding Domain Bound with Testosterone and an AR 20-30 Peptide Descriptor: Androgen receptor, GLYCEROL, SULFATE ION, ... Authors: Gampe, R.T. Deposit date: 2007-06-07 Release date: 2007-07-24 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Modulation of androgen receptor activation function 2 by testosterone and dihydrotestosterone. J.Biol.Chem., 282, 2007
2Q7L	The Androgen Receptor Prostate Cancer Mutant H874Y Ligand Binding Domain Bound with Testosterone and a TIF2 box3 Coactivator Peptide 740-753 Descriptor: Androgen receptor, GLYCEROL, Nuclear receptor coactivator 2, ... Authors: Gampe, R.T. Deposit date: 2007-06-07 Release date: 2007-07-24 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.92 Å) Cite: Modulation of androgen receptor activation function 2 by testosterone and dihydrotestosterone. J.Biol.Chem., 282, 2007
2Q7J	The Wild Type Androgen Receptor Ligand Binding Domain Bound with Testosterone and a TIF2 box 3 Coactivator Peptide 740-753 Descriptor: Androgen receptor, GLYCEROL, Nuclear receptor coactivator 2, ... Authors: Gampe, R.T. Deposit date: 2007-06-07 Release date: 2007-07-24 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Modulation of androgen receptor activation function 2 by testosterone and dihydrotestosterone. J.Biol.Chem., 282, 2007
2Q8S	X-ray Crystal structure of the nuclear hormone receptor PPAR-gamma in a complex with a PPAR gamma/alpha dual agonist Descriptor: (2S)-3-{4-[3-(5-METHYL-2-PHENYL-1,3-OXAZOL-4-YL)PROPYL]PHENYL}-2-(1H-PYRROL-1-YL)PROPANOIC ACID, Peroxisome proliferator-activated receptor gamma Authors: Ohren, J.F. Deposit date: 2007-06-11 Release date: 2008-10-14 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Effects of modifications of the linker in a series of phenylpropanoic acid derivatives: Synthesis, evaluation as PPARalpha/gamma dual agonists, and X-ray crystallographic studies. Bioorg.Med.Chem., 16, 2008
2QAB	Crystal Structure of Estrogen Receptor Alpha Ligand Binding Domain Mutant 537S Complexed with an Ethyl Indazole Compound Descriptor: 3-ETHYL-2-(4-HYDROXYPHENYL)-2H-INDAZOL-5-OL, Estrogen receptor, nuclear receptor coactivator 2 Authors: Nettles, K.W, Bruning, J.B, Nowak, J, Sharma, S.K, Hahm, J.B, Shi, Y, Kulp, K, Hochberg, R.B, Zhou, H, Katzenellenbogen, J.A, Katzenellenbogen, B.S, Kim, Y, Joachmiak, A, Greene, G.L. Deposit date: 2007-06-14 Release date: 2008-03-18 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.89 Å) Cite: NFkappaB selectivity of estrogen receptor ligands revealed by comparative crystallographic analyses Nat.Chem.Biol., 4, 2008
2QA6	Crystal Structure of Estrogen Receptor Alpha mutant 537S Complexed with 4-(6-hydroxy-1H-indazol-3-yl)benzene-1,3-diol Descriptor: 4-(6-HYDROXY-1H-INDAZOL-3-YL)BENZENE-1,3-DIOL, Estrogen receptor, nuclear receptor coactivator 2 Authors: Nettles, K.W, Bruning, J.B, Nowak, J, Sharma, S.K, Hahm, J.B, Shi, Y, Kulp, K, Hochberg, R.B, Zhou, H, Katzenellenbogen, J.A, Katzenellenbogen, B.S, Kim, Y, Joachmiak, A, Greene, G.L. Deposit date: 2007-06-14 Release date: 2008-03-18 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (2.6 Å) Cite: NFkappaB selectivity of estrogen receptor ligands revealed by comparative crystallographic analyses Nat.Chem.Biol., 4, 2008
2Z4B	Estrogen receptor beta ligand-binding domain complexed to a benzopyran ligand Descriptor: (3AS,4R,9BR)-2,2-DIFLUORO-4-(4-HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL, Estrogen receptor beta Authors: Wang, Y. Deposit date: 2007-06-14 Release date: 2007-08-07 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (2.34 Å) Cite: Benzopyrans as selective estrogen receptor beta agonists (SERBAs). Part 3: Synthesis of cyclopentanone and cyclohexanone intermediates for C-ring modification. Bioorg.Med.Chem.Lett., 17, 2007
2QA8	Crystal Structure of the Estrogen Receptor Alpha Ligand Binding Domain Mutant 537S Complexed with Genistein Descriptor: Estrogen receptor, GENISTEIN, nuclear receptor coactivator 2 Authors: Nettles, K.W, Bruning, J.B, Nowak, J, Sharma, S.K, Hahm, J.B, Shi, Y, Kulp, K, Hochberg, R.B, Zhou, H, Katzenellenbogen, J.A, Katzenellenbogen, B.S, Kim, Y, Joachmiak, A, Greene, G.L. Deposit date: 2007-06-14 Release date: 2008-03-18 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.85 Å) Cite: NFkappaB selectivity of estrogen receptor ligands revealed by comparative crystallographic analyses Nat.Chem.Biol., 4, 2008
2Z4J	Crystal structure of AR LBD with SHP peptide NR Box 2 Descriptor: 5-ALPHA-DIHYDROTESTOSTERONE, Androgen receptor, Nuclear receptor 0B2 Authors: Jouravel, N, Fletterick, R.J. Deposit date: 2007-06-19 Release date: 2007-12-04 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Interaction between the androgen receptor and a segment of its corepressor SHP Acta Crystallogr.,Sect.D, 63, 2007
2QE4	Estrogen receptor alpha ligand-binding domain in complex with a benzopyran agonist Descriptor: (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-6-(METHOXYMETHYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL, Estrogen receptor Authors: Norman, B.H, Richardson, T.I, Dodge, J.A, Pfeifer, L.A, Durst, G.L, Wang, Y, Durbin, J.D, Krishnan, V, Dinn, S.R, Liu, S.Q, Reilly, J.E, Ryter, K.T. Deposit date: 2007-06-22 Release date: 2007-09-04 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Benzopyrans as selective estrogen receptor beta agonists (SERBAs). Part 4: Functionalization of the benzopyran A-ring. Bioorg.Med.Chem.Lett., 17, 2007
2QH6	Crystal Structure of the Estrogen Receptor Alpha Ligand Binding Domain Complexed with an Oxabicyclic diarylethylene Compound Descriptor: DIETHYL (1R,2S,3R,4S)-5,6-BIS(4-HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT-5-ENE-2,3-DICARBOXYLATE, Estrogen receptor, Nuclear receptor coactivator 2 Authors: Nettles, K.W, Bruning, J.B, Nowak, J, Sharma, S.K, Hahm, J.B, Shi, Y, Kulp, K, Hochberg, R.B, Zhou, H, Katzenellenbogen, J.A, Katzenellenbogen, B.S, Kim, Y, Joachmiak, A, Greene, G.L. Deposit date: 2007-06-29 Release date: 2008-03-18 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.7 Å) Cite: NFkappaB selectivity of estrogen receptor ligands revealed by comparative crystallographic analyses Nat.Chem.Biol., 4, 2008
2QGT	Crystal Structure of the Estrogen Receptor Alpha Ligand Binding Domain Complexed to an Ether Estradiol Compound Descriptor: (9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)-11-(METHOXYMETHYL)ESTRA-1(10),2,4-TRIENE-3,17-DIOL, Estrogen receptor, Nuclear receptor coactivator 2 Authors: Nettles, K.W, Bruning, J.B, Nowak, J, Sharma, S.K, Hahm, J.B, Shi, Y, Kulp, K, Hochberg, R.B, Zhou, H, Katzenellenbogen, J.A, Katzenellenbogen, B.S, Kim, Y, Joachmiak, A, Greene, G.L. Deposit date: 2007-06-29 Release date: 2008-03-18 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.15 Å) Cite: NFkappaB selectivity of estrogen receptor ligands revealed by comparative crystallographic analyses Nat.Chem.Biol., 4, 2008
2QGW	Crystal Structure of the Estrogen Receptor Alpha Ligand Binding Domain Complexed with a Chloro-Indazole Compound Descriptor: 3-CHLORO-2-(4-HYDROXYPHENYL)-2H-INDAZOL-5-OL, Estrogen receptor, Nuclear receptor coactivator 2 Authors: Nettles, K.W, Bruning, J.B, Nowak, J, Sharma, S.K, Hahm, J.B, Shi, Y, Kulp, K, Hochberg, R.B, Zhou, H, Katzenellenbogen, J.A, Katzenellenbogen, B.S, Kim, Y, Joachmiak, A, Greene, G.L. Deposit date: 2007-06-29 Release date: 2008-03-18 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.39 Å) Cite: NFkappaB selectivity of estrogen receptor ligands revealed by comparative crystallographic analyses Nat.Chem.Biol., 4, 2008
2JJ3	Estrogen receptor beta ligand binding domain in complex with a Benzopyran agonist Descriptor: (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)-6-(METHOXYMETHYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN-8-OL, ESTROGEN RECEPTOR BETA Authors: Norman, B.H, Richardson, T.I, Dodge, J.A, Pfeifer, L.A, Durst, G.L, Wang, Y, Durbin, J.D, Krishnan, V, Dinn, S.R, Liu, S, Reilly, J.E, Ryter, K.T. Deposit date: 2007-07-03 Release date: 2007-08-07 Last modified: 2024-05-08 Method: X-RAY DIFFRACTION (2.28 Å) Cite: Benzopyrans as Selective Estrogen Receptor Beta Agonists (Serbas). Part 4: Functionalization of the Benzopyran A-Ring. Bioorg.Med.Chem.Lett., 17, 2007
2QMV	High Resolution Structure of Peroxisone Proliferation-Activated Receptor gamma and Characterisation of its Interaction with the Co-activator Transcriptional Intermediary Factor 2 Descriptor: Peroxisome proliferator-activated receptor gamma Authors: Hartl, R, Riepl, H, Kauschke, S, Kalbitzer, H.R, Maurer, T. Deposit date: 2007-07-17 Release date: 2008-09-02 Last modified: 2024-05-01 Method: SOLUTION NMR Cite: High Resolution Structure of Peroxisone Proliferation-Activated Receptor gamma and Characterisation of its Interaction with the Co-activator Transcriptional Intermediary Factor 2 To be Published
2QNV	Crystal Structure of the Pregnane X Receptor bound to Colupulone Descriptor: 3,5-dihydroxy-4,6,6-tris(3-methylbut-2-en-1-yl)-2-(2-methylpropanoyl)cyclohexa-2,4-dien-1-one, Orphan nuclear receptor PXR Authors: Teotico, D.G, Bischof, J, Redinbo, M.R. Deposit date: 2007-07-19 Release date: 2008-07-29 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Crystal Structure of the Pregnane X Receptor bound to Colupulone TO BE PUBLISHED
2QPY	AR LBD with small molecule Descriptor: 5-ALPHA-DIHYDROTESTOSTERONE, Androgen receptor, Coactivator peptide, ... Authors: Estebanez-Perpina, E, Fletterick, R. Deposit date: 2007-07-25 Release date: 2007-09-25 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (2.5 Å) Cite: A surface on the androgen receptor that allosterically regulates coactivator binding. Proc.Natl.Acad.Sci.Usa, 104, 2007
2QR9	Crystal Structure of the Estrogen Receptor Alpha Ligand Binding Domain Complexed with an Oxabicyclic Derivative Compound Descriptor: Estrogen receptor, Nuclear receptor coactivator 2, dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)-7-oxabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate Authors: Nettles, K.W, Bruning, J.B. Deposit date: 2007-07-27 Release date: 2008-03-18 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2 Å) Cite: NFkappaB selectivity of estrogen receptor ligands revealed by comparative crystallographic analyses Nat.Chem.Biol., 4, 2008
2V7C	Crystal Structure of Rev-Erb beta Descriptor: ORPHAN NUCLEAR RECEPTOR NR1D2 Authors: Woo, E.-J, Jeong, D.G, Lim, M.-Y, Kim, S.J, Ryu, S.E. Deposit date: 2007-07-29 Release date: 2007-10-23 Last modified: 2011-07-13 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Structural Insight Into the Constitutive Repression Function of the Nuclear Receptor Rev-Erbbeta J.Mol.Biol., 373, 2007

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