PDB: 8861 resultsInfo pagesStatus searchChemie searchBIRD

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4FKR	Crystal structure of the cdk2 in complex with oxindole inhibitor Descriptor: (8Z)-8-{[(2,2-dioxido-1,3-dihydro-2-benzothiophen-5-yl)amino]methylidene}-6,8-dihydro-7H-[1,3]thiazolo[5,4-e]indol-7-one, Cyclin-dependent kinase 2, GLYCEROL Authors: Kang, Y.N, Stuckey, J.A. Deposit date: 2012-06-13 Release date: 2013-05-08 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Crystal structure of the cdk2 in complex with oxindole inhibitor To be Published
4FKL	Crystal structure of the cdk2 in complex with thiazolylpyrimidine inhibitor Descriptor: 4-(2,4-DIMETHYL-1,3-THIAZOL-5-YL)PYRIMIDIN-2-AMINE, Cyclin-dependent kinase 2 Authors: Kang, Y.N, Stuckey, J.A. Deposit date: 2012-06-13 Release date: 2013-05-08 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.26 Å) Cite: Crystal structure of the cdk2 in complex with thiazolylpyrimidine inhibitor To be Published
7CTG	Human Origin Recognition Complex, ORC1-5 State I Descriptor: ADENOSINE-5'-TRIPHOSPHATE, Origin recognition complex subunit 1, Origin recognition complex subunit 2, ... Authors: Cheng, J, Li, N, Wang, X, Hu, J, Zhai, Y, Gao, N. Deposit date: 2020-08-18 Release date: 2021-01-06 Last modified: 2024-03-27 Method: ELECTRON MICROSCOPY (5 Å) Cite: Structural insight into the assembly and conformational activation of human origin recognition complex. Cell Discov, 6, 2020
4EK4	Crystal structure of the cdk2 in complex with aminopyrazole inhibitor Descriptor: 4-bromo-N-(5-methyl-1H-pyrazol-3-yl)benzamide, Cyclin-dependent kinase 2, SODIUM ION Authors: Kang, Y.N, Stuckey, J.A. Deposit date: 2012-04-09 Release date: 2013-05-01 Last modified: 2013-05-08 Method: X-RAY DIFFRACTION (1.26 Å) Cite: Crystal structure of the cdk2 in complex with aminopyrazole inhibitor To be Published
2F21	human Pin1 Fip mutant Descriptor: PENTAETHYLENE GLYCOL, Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 Authors: Jager, M, Zhang, Y, Bowman, M.E, Noel, J.P, Kelly, J.W. Deposit date: 2005-11-15 Release date: 2006-06-20 Last modified: 2023-08-23 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Structure-function-folding relationship in a WW domain. Proc.Natl.Acad.Sci.Usa, 103, 2006
2F6J	Crystal structure of PHD finger-linker-bromodomain fragment of human BPTF in the H3(1-15)K4me3 bound state Descriptor: ZINC ION, bromodomain PHD finger transcription factor, histone H3, ... Authors: Li, H, Patel, D.J. Deposit date: 2005-11-29 Release date: 2006-07-11 Last modified: 2011-07-13 Method: X-RAY DIFFRACTION (2 Å) Cite: Molecular basis for site-specific read-out of histone H3K4me3 by the BPTF PHD finger of NURF. Nature, 442, 2006
5ZJQ	Structure of AbdB/Exd complex bound to a 'Red14' DNA sequence Descriptor: DNA (5'-D(*GP*CP*AP*TP*GP*AP*TP*TP*TP*AP*TP*GP*AP*C)-3'), DNA (5'-D(*GP*TP*CP*AP*TP*AP*AP*AP*TP*CP*AP*TP*GP*C)-3'), Homeobox protein abdominal-B, ... Authors: Baburajendran, N, Zeiske, T, Kaczynska, A, Mann, R, Honig, B, Shapiro, L, Palmer, A.G. Deposit date: 2018-03-22 Release date: 2018-08-29 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2.443 Å) Cite: Intrinsic DNA Shape Accounts for Affinity Differences between Hox-Cofactor Binding Sites. Cell Rep, 24, 2018
4ELL	Structure of the inactive retinoblastoma protein pocket domain Descriptor: Retinoblastoma-associated protein Authors: Burke, J.R, Rubin, S.M. Deposit date: 2012-04-10 Release date: 2012-05-23 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (1.98 Å) Cite: Structures of inactive retinoblastoma protein reveal multiple mechanisms for cell cycle control. Genes Dev., 26, 2012
3L2O	Structure-Based Mechanism of Dimerization-Dependent Ubiquitination by the SCFFbx4 Ubiquitin Ligase Descriptor: F-box only protein 4, S-phase kinase-associated protein 1 Authors: Li, Y, Hao, B. Deposit date: 2009-12-15 Release date: 2010-02-23 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Structural basis of dimerization-dependent ubiquitination by the SCF(Fbx4) ubiquitin ligase. J.Biol.Chem., 285, 2010
4FKO	Crystal structure of the cdk2 in complex with thiazolylpyrimidine inhibitor Descriptor: 2-chloro-N~4~-[4-(2,4-dimethyl-1,3-thiazol-5-yl)pyrimidin-2-yl]-N~1~,N~1~-dimethylbenzene-1,4-diamine, ACETATE ION, Cyclin-dependent kinase 2 Authors: Kang, Y.N, Stuckey, J.A. Deposit date: 2012-06-13 Release date: 2013-05-08 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.55 Å) Cite: Crystal structure of the cdk2 in complex with thiazolylpyrimidine inhibitor To be Published
4FKJ	Crystal structure of the cdk2 in complex with aminopyrazole inhibitor Descriptor: ACETATE ION, Cyclin-dependent kinase 2, N-(3-cyclopropyl-1H-pyrazol-5-yl)-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]acetamide Authors: Kang, Y.N, Stuckey, J.A. Deposit date: 2012-06-13 Release date: 2013-05-08 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (1.63 Å) Cite: Crystal structure of the cdk2 in complex with aminopyrazole inhibitor To be Published
4FKW	Crystal structure of the cdk2 in complex with oxindole inhibitor Descriptor: 2-methylpropyl (3Z)-2-oxo-3-[2-(4-sulfamoylphenyl)hydrazinylidene]-2,3-dihydro-1H-indole-5-carboxylate, Cyclin-dependent kinase 2, GLYCEROL Authors: Kang, Y.N, Stuckey, J.A. Deposit date: 2012-06-13 Release date: 2013-05-08 Last modified: 2013-05-22 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Crystal structure of the cdk2 in complex with oxindole inhibitor To be Published
4FL5	Crystal structure of human 14-3-3 sigma in complex with a Tau-protein peptide surrounding pS214 Descriptor: 14-3-3 protein sigma, CALCIUM ION, CHLORIDE ION, ... Authors: Schumacher, B, Ottmann, C. Deposit date: 2012-06-14 Release date: 2013-12-11 Last modified: 2017-06-07 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Involvement of 14-3-3 in tubulin instability and impaired axon development is mediated by Tau. FASEB J., 29, 2015
1FX9	CARBOXYLIC ESTER HYDROLASE COMPLEX (DIMERIC PLA2 + MJ33 INHIBITOR + SULPHATE IONS) Descriptor: 1-HEXADECYL-3-TRIFLUOROETHYL-SN-GLYCERO-2-PHOSPHATE METHANE, CALCIUM ION, PHOSPHOLIPASE A2, ... Authors: Pan, Y.H, Epstein, T.M, Jain, M.K, Bahnson, B.J. Deposit date: 2000-09-25 Release date: 2001-09-25 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2 Å) Cite: Five coplanar anion binding sites on one face of phospholipase A2: relationship to interface binding. Biochemistry, 40, 2001
2H8H	Src kinase in complex with a quinazoline inhibitor Descriptor: N-(5-CHLORO-1,3-BENZODIOXOL-4-YL)-7-[2-(4-METHYLPIPERAZIN-1-YL)ETHOXY]-5-(TETRAHYDRO-2H-PYRAN-4-YLOXY)QUINAZOLIN-4-AMINE, Proto-oncogene tyrosine-protein kinase Src Authors: Otterbein, L.R, Norman, R, Pauptit, R.A, Rowsell, S, Breed, J. Deposit date: 2006-06-07 Release date: 2006-11-21 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.2 Å) Cite: N-(5-chloro-1,3-benzodioxol-4-yl)-7-[2-(4-methylpiperazin-1-yl)ethoxy]-5- (tetrahydro-2H-pyran-4-yloxy)quinazolin-4-amine, a novel, highly selective, orally available, dual-specific c-Src/Abl kinase inhibitor. J.Med.Chem., 49, 2006
2GJX	Crystallographic structure of human beta-Hexosaminidase A Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Beta-hexosaminidase alpha chain, ... Authors: Lemieux, M.J, Mark, B.L, Cherney, M.M, Withers, S.G, Mahuran, D.J, James, M.N.G. Deposit date: 2006-03-31 Release date: 2006-06-20 Last modified: 2020-07-29 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Crystallographic structure of human beta-Hexosaminidase A: Interpretation of Tay-Sachs Mutations and Loss of GM2 Ganglioside Hydrolysis J.Mol.Biol., 359, 2006
2GVG	Crystal Structure of human NMPRTase and its complex with NMN Descriptor: BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE, Nicotinamide phosphoribosyltransferase, PHOSPHATE ION Authors: Khan, J.A, Tao, X, Tong, L. Deposit date: 2006-05-02 Release date: 2006-06-20 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (2.2 Å) Cite: Molecular basis for the inhibition of human NMPRTase, a novel target for anticancer agents. Nat.Struct.Mol.Biol., 13, 2006
2GH6	Crystal structure of a HDAC-like protein with 9,9,9-trifluoro-8-oxo-N-phenylnonan amide bound Descriptor: 9,9,9-TRIFLUORO-8-OXO-N-PHENYLNONANAMIDE, Histone deacetylase-like amidohydrolase, POTASSIUM ION, ... Authors: Nielsen, T.K, Hildmann, C, Riester, D, Wegener, D, Schwienhorst, A, Ficner, R. Deposit date: 2006-03-26 Release date: 2007-03-20 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.203 Å) Cite: Complex structure of a bacterial class 2 histone deacetylase homologue with a trifluoromethylketone inhibitor. Acta Crystallogr.,Sect.F, 63, 2007
2G9X	Structure of Thr 160 phosphorylated CDK2/cyclin A in complex with the inhibitor NU6271 Descriptor: 3-({2-[(4-{[6-(CYCLOHEXYLMETHOXY)-9H-PURIN-2-YL]AMINO}PHENYL)SULFONYL]ETHYL}AMINO)PROPAN-1-OL, Cell division protein kinase 2, Cyclin-A2 Authors: Echalier, A, Endicott, J.A, Noble, M.E. Deposit date: 2006-03-07 Release date: 2006-05-23 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Searching for Cyclin-Dependent Kinase Inhibitors Using a New Variant of the Cope Elimination. J.Am.Chem.Soc., 128, 2006
6ATB	Crystal Structure of human NAMPT in complex with NVP-LOD812 Descriptor: DIMETHYL SULFOXIDE, GLYCEROL, N-{4-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]phenyl}-N'-[(pyridin-3-yl)methyl]urea, ... Authors: Weihofen, W.A, Thigale, S. Deposit date: 2017-08-28 Release date: 2018-09-12 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.53 Å) Cite: Identification and structure based design of cellularly active cyclo-propyl carboxamide Nicotinamide phosphoribosyltransferase (NAMPT) inhibitors To Be Published
2G96	Crystal Structure of Visfatin/Pre-B Cell Colony Enhancing Factor 1/Nicotinamide Phosphoribosyltransferase In Complex with Niconamide Mononucleotide Descriptor: BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE, Nicotinamide phosphoribosyltransferase Authors: Eom, S.H, Kim, M.-K. Deposit date: 2006-03-05 Release date: 2006-08-01 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Crystal Structure of Visfatin/Pre-B Cell Colony-enhancing Factor 1/Nicotinamide Phosphoribosyltransferase, Free and in Complex with the Anti-cancer Agent FK-866 J.Mol.Biol., 362, 2006
4HCA	DNA binding by GATA transcription factor-complex 1 Descriptor: DNA (5'-D(*AP*AP*TP*GP*TP*CP*CP*AP*TP*CP*TP*GP*AP*TP*AP*AP*GP*AP*CP*G)-3'), DNA (5'-D(*TP*TP*CP*GP*TP*CP*TP*TP*AP*TP*CP*AP*GP*AP*TP*GP*GP*AP*CP*A)-3'), Trans-acting T-cell-specific transcription factor GATA-3, ... Authors: Chen, Y, Bates, D.L, Dey, R, Chen, L. Deposit date: 2012-09-28 Release date: 2012-12-05 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.8 Å) Cite: DNA Binding by GATA Transcription Factor Suggests Mechanisms of DNA Looping and Long-Range Gene Regulation. Cell Rep, 2, 2012
4HCP	crystal structure of Burkholderia pseudomallei effector protein chbp in complex with nedd8 Descriptor: GLYCEROL, NEDD8, Putative ATP/GTP binding protein, ... Authors: Yao, Q, Shao, F. Deposit date: 2012-10-01 Release date: 2012-11-21 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.52 Å) Cite: Structural mechanism of ubiquitin and NEDD8 deamidation catalyzed by bacterial effectors that induce macrophage-specific apoptosis. Proc.Natl.Acad.Sci.USA, 109, 2012
1GA3	NMR STRUCTURE OF INTERLEUKIN-13 Descriptor: Interleukin-13 Authors: Eisenmesser, E.Z, Horita, D.A, Altieri, A.S, Byrd, R.A. Deposit date: 2000-11-29 Release date: 2001-07-04 Last modified: 2023-06-14 Method: SOLUTION NMR Cite: Solution structure of interleukin-13 and insights into receptor engagement J.Mol.Biol., 310, 2001
6CQ5	TBK1 in Complex with Sulfone Analog of Amlexanox Descriptor: 2-amino-7-(1,1-dioxo-1lambda~6~-thian-4-yl)-5-oxo-5H-[1]benzopyrano[2,3-b]pyridine-3-carboxylic acid, Serine/threonine-protein kinase TBK1 Authors: Beyett, T.S, Tesmer, J.J.G. Deposit date: 2018-03-14 Release date: 2018-12-05 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (3.354 Å) Cite: Design, synthesis, and biological activity of substituted 2-amino-5-oxo-5H-chromeno[2,3-b]pyridine-3-carboxylic acid derivatives as inhibitors of the inflammatory kinases TBK1 and IKK epsilon for the treatment of obesity. Bioorg. Med. Chem., 26, 2018

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