PDB: 222415 resultsInfo pagesStatus searchChemie searchBIRD

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4GGD	Structural analysis of human Cdc20 supports multisite degron recognition by APC/C. Descriptor: Cell division cycle protein 20 homolog, Mitotic checkpoint serine/threonine-protein kinase BUB1 beta Authors: Luo, X, Tian, W, Tomchick, D.R. Deposit date: 2012-08-06 Release date: 2012-11-07 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (2.435 Å) Cite: Structural analysis of human Cdc20 supports multisite degron recognition by APC/C. Proc.Natl.Acad.Sci.USA, 109, 2012
2RBE	The discovery of 2-anilinothiazolones as 11beta-HSD1 inhibitors Descriptor: (5R)-2-[(2-fluorophenyl)amino]-5-(1-methylethyl)-1,3-thiazol-4(5H)-one, Corticosteroid 11-beta-dehydrogenase isozyme 1, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Zhang, J, Jordan, S.R, Li, V. Deposit date: 2007-09-18 Release date: 2008-01-15 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.9 Å) Cite: The discovery of 2-anilinothiazolones as 11beta-HSD1 inhibitors. Bioorg.Med.Chem.Lett., 17, 2007
4GJZ	JMJD5 in complex with 2-oxoglutarate Descriptor: 2-OXOGLUTARIC ACID, BETA-MERCAPTOETHANOL, COBALT (II) ION, ... Authors: Del Rizzo, P.A, Trievel, R.C. Deposit date: 2012-08-10 Release date: 2012-09-05 Last modified: 2012-11-14 Method: X-RAY DIFFRACTION (1.0481 Å) Cite: Crystal Structure and Functional Analysis of JMJD5 Indicate an Alternate Specificity and Function. Mol.Cell.Biol., 32, 2012
2RFM	Structure of a Thermophilic Ankyrin Repeat Protein Descriptor: 1,3-BUTANEDIOL, CHLORIDE ION, GLYCEROL, ... Authors: Loew, C, Weininger, U, Neumann, P, Stubbs, M.T, Balbach, J. Deposit date: 2007-10-01 Release date: 2008-03-11 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Structural insights into an equilibrium folding intermediate of an archaeal ankyrin repeat protein Proc.Natl.Acad.Sci.Usa, 105, 2008
5RSB	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000001674697 Descriptor: 7-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
5RSQ	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000158490 Descriptor: 5-methyl-3-phenyl-1,2-oxazole-4-carboxylic acid, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
4GLA	OBody NL8 bound to hen egg-white lysozyme Descriptor: Lysozyme C, OBody NL8 Authors: Steemson, J.D. Deposit date: 2012-08-14 Release date: 2013-08-14 Last modified: 2014-02-12 Method: X-RAY DIFFRACTION (2.75 Å) Cite: Tracking Molecular Recognition at the Atomic Level with a New Protein Scaffold Based on the OB-Fold. Plos One, 9, 2014
5RT6	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000156509 Descriptor: 2-(3,4-dichlorophenyl)ethanoic acid, DIMETHYL SULFOXIDE, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
5RTM	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000002005 Descriptor: Non-structural protein 3, PYRAZINE-2-CARBOXAMIDE Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
2RHJ	Synthetic Gene Encoded Bacillus Subtilis FtsZ with Two Sulfate Ions and Sodium Ion in the Nucleotide Pocket Descriptor: ACETATE ION, Cell Division Protein ftsZ, SODIUM ION, ... Authors: Lovell, S, Halloran, Z, Hjerrild, K, Sheridan, D, Burgin, A, Stewart, L, Accelerated Technologies Center for Gene to 3D Structure (ATCG3D) Deposit date: 2007-10-09 Release date: 2008-10-21 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.761 Å) Cite: Combined protein construct and synthetic gene engineering for heterologous protein expression and crystallization using Gene Composer. BMC Biotechnol., 9, 2009
5RU0	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000388514 Descriptor: (2,6-DICHLOROPHENYL)ACETIC ACID, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
5RUH	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000123600 Descriptor: (2,6-dichlorophenoxy)acetic acid, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
2RIY	B-specific-1,3-galactosyltransferase (GTB)+H-antigen acceptor Descriptor: Glycoprotein-fucosylgalactoside alpha-galactosyltransferase, octyl 2-O-(6-deoxy-alpha-L-galactopyranosyl)-beta-D-galactopyranoside Authors: Evans, S.V, Alfaro, J.A. Deposit date: 2007-10-13 Release date: 2008-02-05 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.55 Å) Cite: ABO(H) blood group A and B glycosyltransferases recognize substrate via specific conformational changes. J.Biol.Chem., 283, 2008
5RUY	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000013517187 Descriptor: Non-structural protein 3, XANTHINE Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
2RIF	CBS domain protein PAE2072 from Pyrobaculum aerophilum complexed with AMP Descriptor: ADENOSINE MONOPHOSPHATE, CESIUM ION, Conserved protein with 2 CBS domains Authors: Lee, T.M, King, N.P, Sawaya, M.R, Cascio, D, Yeates, T.O. Deposit date: 2007-10-10 Release date: 2008-06-17 Last modified: 2017-10-25 Method: X-RAY DIFFRACTION (2.35 Å) Cite: Structures and Functional Implications of an AMP-Binding Cystathionine beta-Synthase Domain Protein from a Hyperthermophilic Archaeon. J.Mol.Biol., 380, 2008
2RJT	Crystal Structure Analysis of a Surface Entropy Reduction Mutant of S. pneumoniae FabF Descriptor: Beta-ketoacyl-ACP synthase II Authors: Soisson, S.M, Parthasarathy, G, Becker, J. Deposit date: 2007-10-15 Release date: 2008-01-22 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.75 Å) Cite: Surface-entropy reduction approaches to manipulate crystal forms of beta-ketoacyl acyl carrier protein synthase II from Streptococcus pneumoniae. Acta Crystallogr.,Sect.D, 64, 2008
5RVE	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000736709772 Descriptor: Non-structural protein 3, {[(2S)-1-oxo-1-(2-oxoimidazolidin-1-yl)propan-2-yl]sulfanyl}acetic acid Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
5RSE	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000336438345 Descriptor: 4-[(3R)-3-fluoropiperidin-1-yl]-7H-pyrrolo[2,3-d]pyrimidine, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
2R56	Crystal Structure of a Recombinant IgE Fab Fragment in Complex with Bovine Beta-Lactoglobulin Allergen Descriptor: Beta-lactoglobulin, DODECYL-BETA-D-MALTOSIDE, IgE Fab Fragment, ... Authors: Niemi, M, Kallio, J.M, Hakulinen, N, Rouvinen, J. Deposit date: 2007-09-03 Release date: 2007-11-13 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Molecular interactions between a recombinant IgE antibody and the beta-lactoglobulin allergen. Structure, 15, 2007
5RSR	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000158650 Descriptor: 2-HYDROXYMETHYL-BENZOIMIDAZOLE, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
5RT5	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000058111 Descriptor: 7-hydroxy-2H-chromen-2-one, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
5RTL	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000388056 Descriptor: 4-methylbenzenesulfonamide, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
2R6J	Structure of Eugenol Synthase from Ocimum basilicum Descriptor: Eugenol synthase 1, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE Authors: Louie, G.V, Noel, J.P, Bowman, M.E. Deposit date: 2007-09-05 Release date: 2008-01-15 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Structure and reaction mechanism of basil eugenol synthase Plos One, 2, 2007
5RU2	PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000000331715 Descriptor: 2-phenoxyethanoic acid, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021
4GI5	Crystal Structure Of a Putative quinone reductase from Klebsiella pneumoniae (Target PSI-013613) Descriptor: CHLORIDE ION, FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, ... Authors: Kumar, P.R, Ahmed, M, Banu, N, Bhosle, R, Bonanno, J, Chamala, S, Chowdhury, S, Gizzi, A, Glen, S, Hammonds, J, Hillerich, B, Love, J.D, Seidel, R, Stead, M, Toro, R, Washington, E, Almo, S.C, New York Structural Genomics Research Consortium (NYSGRC) Deposit date: 2012-08-08 Release date: 2012-08-22 Last modified: 2017-11-15 Method: X-RAY DIFFRACTION (1.75 Å) Cite: Crystal structure of a quinone reductase from Klebsiella pneumoniae with bound FAD to be published

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