PDB: 12060 resultsInfo pagesStatus searchChemie searchBIRD

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6LN1	A natural inhibitor of DYRK1A for treatment of diabetes mellitus Descriptor: 1,3,5,8-tetrakis(oxidanyl)xanthen-9-one, Dual specificity tyrosine-phosphorylation-regulated kinase 1A Authors: Li, H, Chen, L.X, Zheng, M.Z, Zhang, Q.Z, Zhang, C.L, Wu, C.R, Yang, K.Y, Song, Z.R, Wang, Q.Q, Li, C, Zhou, Y.R, Chen, J.C. Deposit date: 2019-12-28 Release date: 2021-10-06 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2.699 Å) Cite: A natural DYRK1A inhibitor as a potential stimulator for beta-cell proliferation in diabetes. Clin Transl Med, 11, 2021
8IYB	Structure insight into substrate recognition and catalysis by feruloyl esterase from Aspergillus sydowii Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 3-(4-HYDROXY-3-METHOXYPHENYL)-2-PROPENOIC ACID, ... Authors: Phienluphon, A, Kondo, K, Mikami, B, Nagata, T, Katahira, M. Deposit date: 2023-04-04 Release date: 2023-10-25 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Structural insights into the molecular mechanisms of substrate recognition and hydrolysis by feruloyl esterase from Aspergillus sydowii. Int.J.Biol.Macromol., 253, 2023
8IYC	Structure insight into substrate recognition and catalysis by feruloyl esterase from Aspergillus sydowii Descriptor: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, ACETATE ION, ... Authors: Phienluphon, A, Kondo, K, Mikami, B, Nagata, T, Katahira, M. Deposit date: 2023-04-04 Release date: 2023-10-25 Method: X-RAY DIFFRACTION (1.55 Å) Cite: Structural insights into the molecular mechanisms of substrate recognition and hydrolysis by feruloyl esterase from Aspergillus sydowii. Int.J.Biol.Macromol., 253, 2023
3L4O	Crystal Structure of the MauG/pre-Methylamine Dehydrogenase Complex After Treatment with Hydrogen Peroxide Descriptor: ACETATE ION, CALCIUM ION, HEME C, ... Authors: Jensen, L.M.R, Wilmot, C.M. Deposit date: 2009-12-21 Release date: 2010-03-23 Last modified: 2023-09-06 Method: X-RAY DIFFRACTION (2.046 Å) Cite: In crystallo posttranslational modification within a MauG/pre-methylamine dehydrogenase complex. Science, 327, 2010
5BQI	Discovery of a Potent and Selective mPGES-1 Inhibitor for the Treatment of Pain Descriptor: (2-hydroxyethoxy)acetaldehyde, 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 Last modified: 2024-03-06 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
4XUJ	Nucleosome core particle containing adducts from treatment with a thiomorpholine-substituted [(eta-6-p-cymene)Ru(3-hydroxy-2-pyridone)Cl] compound Descriptor: DNA (145-MER), Histone H2A, Histone H2B 1.1, ... Authors: Adhireksan, Z, Davey, C.A. Deposit date: 2015-01-26 Release date: 2016-01-27 Last modified: 2023-11-08 Method: X-RAY DIFFRACTION (3.18 Å) Cite: Contrasting Cytotoxicity and Reactivity of RuII-Arene Complexes of Morpholine vs Thiomorpholine Substituted 3-Hydroxy-2-pyridone Ligands To Be Published
5BQH	Discovery of a Potent and Selective mPGES-1 Inhibitor for the Treatment of Pain Descriptor: (2-hydroxyethoxy)acetaldehyde, GLUTATHIONE, N-[4-(4-chlorophenyl)-1H-imidazol-2-yl]-2-(difluoromethyl)-5-{[(2-methylpropanoyl)amino]methyl}benzamide, ... 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 Last modified: 2024-03-06 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
5EBX	THE CRYSTAL STRUCTURE OF ERABUTOXIN A AT 2.0 ANGSTROMS RESOLUTION Descriptor: ERABUTOXIN A, SULFATE ION Authors: Corfield, P.W.R, Lee, T.-J, Low, B.W. Deposit date: 1989-12-20 Release date: 1990-04-15 Last modified: 2017-11-29 Method: X-RAY DIFFRACTION (2 Å) Cite: The crystal structure of erabutoxin a at 2.0-A resolution. J.Biol.Chem., 264, 1989
2R22	Structure of the native RNA tridecamer r(GCGUUUGAAACGC) at 1.5 A (NatMn) Descriptor: MANGANESE (II) ION, RNA (5'-R(*GP*CP*GP*UP*UP*UP*GP*AP*AP*AP*CP*GP*C)-3'), SODIUM ION Authors: Timsit, Y, Bombard, S. Deposit date: 2007-08-24 Release date: 2007-09-25 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.4 Å) Cite: The 1.3 A structure of the tridecamer r(GCGUUUGAAACGC) TO BE PUBLISHED
6IC1	urate oxidase under 90 bar of krypton Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 8-AZAXANTHINE, ACETATE ION, ... Authors: Prange, T, Colloc'h, N, Carpentier, P. Deposit date: 2018-12-01 Release date: 2019-12-18 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.1 Å) Cite: Comparative study of the effects of high hydrostatic pressure per se and high argon pressure on urate oxidase ligand stabilization Acta Cryst. D, 78, 2022
8VJS	Cryo-EM structure of Tulane virus 9-6-17 variant capsid protein VP1 9-14-18 without DTT treatment Descriptor: Capsid protein Authors: Sun, C, Jiang, W. Deposit date: 2024-01-07 Release date: 2024-02-07 Method: ELECTRON MICROSCOPY (2.73 Å) Cite: The 2.6 angstrom Structure of a Tulane Virus Variant with Minor Mutations Leading to Receptor Change. Biomolecules, 14, 2024
6S7I	Arbitrium receptor from a Bacillus subtilis Katmira33 phage Descriptor: Arbitrium receptor, SULFATE ION Authors: Marina, A, Gallego del Sol, F. Deposit date: 2019-07-05 Release date: 2021-04-14 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Insights into the mechanism of action of the arbitrium communication system in SPbeta phages. Nat Commun, 13, 2022
6S7L	Arbitrium receptor from a Bacillus subtilis Katmira33 phage Descriptor: Arbitrium receptor, GLY-ILE-VAL-ARG-GLY-ALA, GLYCEROL Authors: Marina, A, Gallego del Sol, F. Deposit date: 2019-07-05 Release date: 2021-04-14 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Insights into the mechanism of action of the arbitrium communication system in SPbeta phages. Nat Commun, 13, 2022
6I9Z	urate oxidase under 65 bar of argon Descriptor: 8-AZAXANTHINE, ARGON, SODIUM ION, ... Authors: Prange, T, Colloc'h, N, Carpentier, P. Deposit date: 2018-11-26 Release date: 2019-12-18 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Comparative study of the effects of high hydrostatic pressure per se and high argon pressure on urate oxidase ligand stabilization Acta Cryst. D, 78, 2022
6SGL	Crystal structure of monooxygenase RutA complexed with Uracil under atmospheric pressure. Descriptor: FLAVIN MONONUCLEOTIDE, Pyrimidine monooxygenase RutA, SULFATE ION, ... Authors: Saleem-Batcha, R, Matthews, A, Teufel, R. Deposit date: 2019-08-05 Release date: 2020-02-05 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (2.01 Å) Cite: Aminoperoxide adducts expand the catalytic repertoire of flavin monooxygenases. Nat.Chem.Biol., 16, 2020
3ERA	RECOMBINANT ERABUTOXIN A (S8T MUTANT) Descriptor: ERABUTOXIN A, THIOCYANATE ION Authors: Gaucher, J.F, Menez, R, Arnoux, B, Menez, A, Ducruix, A. Deposit date: 1997-06-25 Release date: 1997-12-31 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (1.7 Å) Cite: High resolution x-ray analysis of two mutants of a curaremimetic snake toxin Eur.J.Biochem., 267, 2000
3WWA	Crystal structure of the computationally designed Pizza7 protein after heat treatment Descriptor: ISOPROPYL ALCOHOL, Pizza7H protein Authors: Voet, A.R.D, Noguchi, H, Addy, C, Simoncini, D, Terada, D, Unzai, S, Park, S.Y, Zhang, K.Y.J, Tame, J.R.H. Deposit date: 2014-06-17 Release date: 2014-10-08 Last modified: 2024-03-20 Method: X-RAY DIFFRACTION (1.988 Å) Cite: Computational design of a self-assembling symmetrical beta-propeller protein. Proc.Natl.Acad.Sci.USA, 111, 2014
6HEX	Crystal Structure of Ephrin A2 (EphA2) Receptor Protein Kinase with the NVP-BHG712 derivative ATMM006 Descriptor: 4-methyl-3-[(1-methyl-6-pyrazin-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]-~{N}-[3-(trifluoromethyl)phenyl]benzamide, Ephrin type-A receptor 2 Authors: Kudlinzki, D, Troester, A, Witt, K, Linhard, V.L, Gande, S.L, Saxena, K, Schwalbe, H. Deposit date: 2018-08-20 Release date: 2019-08-28 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (1.413 Å) Cite: Effects of NVP-BHG712 chemical modifications on EPHA2 binding and affinity To Be Published
8TDL	Cryo-EM structure of the wild-type AtMSL10 in saposin Descriptor: Mechanosensitive ion channel protein 10 Authors: Zhang, J, Yuan, P. Deposit date: 2023-07-03 Release date: 2023-10-18 Method: ELECTRON MICROSCOPY (3.6 Å) Cite: Open structure and gating of the Arabidopsis mechanosensitive ion channel MSL10. Nat Commun, 14, 2023
6IA1	urate oxidase under 120 bar of argon Descriptor: 8-AZAXANTHINE, ACETATE ION, ARGON, ... Authors: Prange, T, Colloc'h, N, Carpentier, P. Deposit date: 2018-11-26 Release date: 2019-12-18 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (2.36 Å) Cite: Comparative study of the effects of high hydrostatic pressure per se and high argon pressure on urate oxidase ligand stabilization Acta Cryst. D, 78, 2022
6IA9	urate oxidase under 2000 bar (220 MPa) of argon Descriptor: 8-AZAXANTHINE, ACETYL GROUP, ARGON, ... Authors: Prange, T, Colloc'h, N, Carpentier, P. Deposit date: 2018-11-26 Release date: 2019-12-18 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.8 Å) Cite: Comparative study of the effects of high hydrostatic pressure per se and high argon pressure on urate oxidase ligand stabilization Acta Cryst. D, 78, 2022
6I9X	urate oxidase under 35 bar of argon Descriptor: 8-AZAXANTHINE, ARGON, SODIUM ION, ... Authors: Prange, T, Colloc'h, N. Deposit date: 2018-11-26 Release date: 2019-12-18 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Comparative study of the effects of high hydrostatic pressure per se and high argon pressure on urate oxidase ligand stabilization Acta Cryst. D, 78, 2022
4B1E	New Aminoimidazoles as BACE-1 Inhibitors: From Rational Design to Ab- lowering in Brain Descriptor: (2R)-2-methyl-5-phenyl-2-(3-pyridin-3-ylphenyl)-2,3-dihydro-1H-imidazol-4-amine, BETA-SECRETASE 1 Authors: Rahm, F, Blid, J, Ginman, T, Karlstrom, S, Kihlstrom, J, Kolmodin, K, Lindstrom, J, von Berg, S, von Kieseritzky, F, Slivo, C, Swahn, B, Viklund, J, Olsson, L, Johansson, P, Eketjall, S, Falting, J, Jeppsson, F, Stromberg, K, Janson, J, Gravenfors, Y. Deposit date: 2012-07-10 Release date: 2012-10-10 Last modified: 2018-02-14 Method: X-RAY DIFFRACTION (1.95 Å) Cite: New aminoimidazoles as beta-secretase (BACE-1) inhibitors showing amyloid-beta (A beta ) lowering in brain. J. Med. Chem., 55, 2012
4ACP	Deactivation of human IgG1 Fc by endoglycosidase treatment Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, IG GAMMA-1 CHAIN C REGION Authors: Raman, K, Bowden, T.A, Krishna, B.A, Dwek, R.A, Crispin, M, Scanlan, C.N. Deposit date: 2011-12-16 Release date: 2012-04-25 Last modified: 2023-12-20 Method: X-RAY DIFFRACTION (2.49 Å) Cite: Selective Deactivation of Serum Igg: A General Strategy for the Enhancement of Monoclonal Antibody Receptor Interactions. J.Mol.Biol., 420, 2012
6RGM	urate oxidase under 130 bar of krypton Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 8-AZAXANTHINE, ACETATE ION, ... Authors: Prange, T, Colloc'h, N, Carpentier, P. Deposit date: 2019-04-17 Release date: 2020-05-13 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Comparative study of the effects of high hydrostatic pressure per se and high argon pressure on urate oxidase ligand stabilization Acta Cryst. D, 78, 2022

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