PDB: 280 resultsInfo pagesStatus searchChemie searchBIRD

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5QLN	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure COMU_1) Descriptor: Thiol:disulfide interchange protein Authors: Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. Deposit date: 2019-01-27 Release date: 2020-02-05 Last modified: 2020-07-22 Method: X-RAY DIFFRACTION (2.409 Å) Cite: Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
5QKY	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure B12_1) Descriptor: Thiol:disulfide interchange protein Authors: Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. Deposit date: 2019-01-27 Release date: 2020-02-05 Last modified: 2020-07-22 Method: X-RAY DIFFRACTION (2.416 Å) Cite: Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
5QKQ	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure A7_1) Descriptor: Thiol:disulfide interchange protein Authors: Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. Deposit date: 2019-01-27 Release date: 2020-02-05 Last modified: 2020-07-22 Method: X-RAY DIFFRACTION (2.423 Å) Cite: Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
5QLG	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure C3_1) Descriptor: Thiol:disulfide interchange protein Authors: Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. Deposit date: 2019-01-27 Release date: 2020-02-05 Last modified: 2020-07-22 Method: X-RAY DIFFRACTION (2.48 Å) Cite: Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
5QKM	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure A5_1) Descriptor: Thiol:disulfide interchange protein Authors: Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. Deposit date: 2019-01-27 Release date: 2020-02-05 Last modified: 2020-07-22 Method: X-RAY DIFFRACTION (2.487 Å) Cite: Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
5VYO	The complex structure of Burkholderia pseudomallei DsbA bound to a peptide Descriptor: Disulfide bond formation protein B, Thiol:disulfide interchange protein Authors: McMahon, R.M, Martin, J.L. Deposit date: 2017-05-25 Release date: 2018-03-21 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.49 Å) Cite: Virulence of the Melioidosis Pathogen Burkholderia pseudomallei Requires the Oxidoreductase Membrane Protein DsbB. Infect. Immun., 86, 2018
8DG0	Crystal Structure of EcDsbA in a complex with Urea Descriptor: COPPER (II) ION, Thiol:disulfide interchange protein DsbA, UREA Authors: Whitehouse, R.L, Ilyichova, O.V, Taylor, A.J. Deposit date: 2022-06-23 Release date: 2022-12-07 Last modified: 2023-10-25 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Fragment screening libraries for the identification of protein hot spots and their minimal binding pharmacophores. Rsc Med Chem, 14, 2023
1R4W	Crystal structure of Mitochondrial class kappa glutathione transferase Descriptor: GLUTATHIONE, Glutathione S-transferase, mitochondrial Authors: Ladner, J.E, Parsons, J.F, Rife, C.L, Gilliland, G.L, Armstrong, R.N. Deposit date: 2003-10-08 Release date: 2004-02-03 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Parallel Evolutionary Pathways for Glutathione Transferases: Structure and Mechanism of the Mitochondrial Class Kappa Enzyme rGSTK1-1 Biochemistry, 43, 2004
4TKY	The complex structure of E. coli DsbA bound to a peptide at the DsbA/DsbB interface Descriptor: ACETYL GROUP, AMINO GROUP, PRO-PHE-ALA-THR-CYS-ASP-SER, ... Authors: Premkumar, L, Martin, J.L. Deposit date: 2014-05-28 Release date: 2015-01-14 Last modified: 2023-09-27 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Peptide Inhibitors of the Escherichia coli DsbA Oxidative Machinery Essential for Bacterial Virulence. J.Med.Chem., 58, 2015
5QKR	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure A7_2) Descriptor: Thiol:disulfide interchange protein Authors: Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. Deposit date: 2019-01-27 Release date: 2020-02-05 Last modified: 2020-07-22 Method: X-RAY DIFFRACTION (2.502 Å) Cite: Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
5QLP	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure D1_1) Descriptor: Thiol:disulfide interchange protein Authors: Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. Deposit date: 2019-01-27 Release date: 2020-02-05 Last modified: 2020-07-22 Method: X-RAY DIFFRACTION (2.521 Å) Cite: Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
1TI1	crystal structure of a mutant DsbA Descriptor: DODECANE, Thiol:disulfide interchange protein dsbA Authors: Kone, A, Serre, L. Deposit date: 2004-06-02 Release date: 2005-05-03 Last modified: 2023-08-23 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Intriguing conformation changes associated with the trans/cis isomerization of a prolyl residue in the active site of the DsbA C33A mutant. J.Mol.Biol., 347, 2005
7RGV	Structure of Caulobacter crescentus Suppressor of copper sensitivity protein C Descriptor: Thioredoxin domain-containing protein Authors: Petit, G.A, Martin, J.L, Gulbis, J.M. Deposit date: 2021-07-15 Release date: 2022-03-02 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.63 Å) Cite: The suppressor of copper sensitivity protein C from Caulobacter crescentus is a trimeric disulfide isomerase that binds copper(I) with subpicomolar affinity. Acta Crystallogr D Struct Biol, 78, 2022
2B6M	Structure of the DsbA mutant (P31A-C33A) Descriptor: DI(HYDROXYETHYL)ETHER, Thiol:disulfide interchange protein dsbA Authors: Vives, C, Royant, A, Serre, L. Deposit date: 2005-10-03 Release date: 2006-10-17 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.65 Å) Cite: Structure of the DsbA mutant To be Published
5QKH	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure A2_1) Descriptor: Thiol:disulfide interchange protein Authors: Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. Deposit date: 2019-01-27 Release date: 2020-02-05 Last modified: 2020-07-22 Method: X-RAY DIFFRACTION (2.654 Å) Cite: Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
5QKL	Group deposition of library data - Crystal Structure of EcDsbA after initial refinement with no ligand modelled (structure A4_1) Descriptor: Thiol:disulfide interchange protein Authors: Ilyichova, O.V, Bentley, M.R, Doak, B.C, Scanlon, M.J. Deposit date: 2019-01-27 Release date: 2020-02-05 Last modified: 2020-07-22 Method: X-RAY DIFFRACTION (2.697 Å) Cite: Rapid Elaboration of Fragments into Leads by X-ray Crystallographic Screening of Parallel Chemical Libraries (REFiLX). J.Med.Chem., 63, 2020
1A2L	REDUCED DSBA AT 2.7 ANGSTROMS RESOLUTION Descriptor: DISULFIDE BOND FORMATION PROTEIN Authors: Martin, J.L, Guddat, L.W. Deposit date: 1998-01-06 Release date: 1998-07-08 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Crystal structures of reduced and oxidized DsbA: investigation of domain motion and thiolate stabilization. Structure, 6, 1998
1A2M	OXIDIZED DSBA AT 2.7 ANGSTROMS RESOLUTION, CRYSTAL FORM III Descriptor: DISULFIDE BOND FORMATION PROTEIN Authors: Martin, J.L, Guddat, L.W. Deposit date: 1998-01-06 Release date: 1998-07-08 Last modified: 2023-08-02 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Crystal structures of reduced and oxidized DsbA: investigation of domain motion and thiolate stabilization. Structure, 6, 1998
1BQ7	DSBA MUTANT P151A, ROLE OF THE CIS-PROLINE IN THE ACTIVE SITE OF DSBA Descriptor: PROTEIN (DISULFIDE OXIDOREDUCTASE) Authors: Charbonnier, J.-B, Stura, E.A. Deposit date: 1998-08-21 Release date: 1999-08-20 Last modified: 2023-08-09 Method: X-RAY DIFFRACTION (2.8 Å) Cite: On the role of the cis-proline residue in the active site of DsbA. Protein Sci., 8, 1999
3E9J	Structure of the charge-transfer intermediate of the transmembrane redox catalyst DsbB Descriptor: Thiol/disulfide oxidoreductase DsbA, Thiol/disulfide oxidoreductase DsbB, UBIQUINONE-1 Authors: Malojcic, G, Owen, R.L, Glockshuber, R. Deposit date: 2008-08-22 Release date: 2008-11-25 Last modified: 2023-08-30 Method: X-RAY DIFFRACTION (3.7 Å) Cite: Preparation and structure of the charge-transfer intermediate of the transmembrane redox catalyst DsbB. Febs Lett., 582, 2008
2ZUP	Updated crystal structure of DsbB-DsbA complex from E. coli Descriptor: Disulfide bond formation protein B, Thiol:disulfide interchange protein dsbA, UBIQUINONE-1, ... Authors: Inaba, K, Suzuki, M, Murakami, S, Nakagawa, A. Deposit date: 2008-10-28 Release date: 2009-04-14 Last modified: 2023-11-01 Method: X-RAY DIFFRACTION (3.7 Å) Cite: Dynamic nature of disulphide bond formation catalysts revealed by crystal structures of DsbB Embo J., 28, 2009
2HI7	Crystal structure of DsbA-DsbB-ubiquinone complex Descriptor: Disulfide bond formation protein B, Thiol:disulfide interchange protein dsbA, UBIQUINONE-1, ... Authors: Inaba, K, Murakami, S, Suzuki, M, Nakagawa, A, Yamashita, E, Okada, K, Ito, K. Deposit date: 2006-06-29 Release date: 2006-12-05 Last modified: 2021-11-10 Method: X-RAY DIFFRACTION (3.7 Å) Cite: Crystal Structure of the DsbB-DsbA Complex Reveals a Mechanism of Disulfide Bond Generation Cell(Cambridge,Mass.), 127, 2006
1A23	SOLUTION NMR STRUCTURE OF REDUCED DSBA FROM ESCHERICHIA COLI, MINIMIZED AVERAGE STRUCTURE Descriptor: DSBA Authors: Schirra, H.J, Renner, C, Czisch, M, Huber-Wunderlich, M, Holak, T.A, Glockshuber, R. Deposit date: 1998-01-15 Release date: 1998-09-16 Last modified: 2024-05-22 Method: SOLUTION NMR Cite: Structure of reduced DsbA from Escherichia coli in solution. Biochemistry, 37, 1998
2MBT	NMR study of PaDsbA Descriptor: Thiol:disulfide interchange protein DsbA Authors: Rimmer, K, Mohanty, B, Scanlon, M.J. Deposit date: 2013-08-03 Release date: 2014-11-12 Last modified: 2023-06-14 Method: SOLUTION NMR Cite: Fragment library screening identifies hits that bind to the non-catalytic surface of Pseudomonas aeruginosa DsbA1. PLoS ONE, 12, 2017
2NDO	Structure of EcDsbA-sulfonamide1 complex Descriptor: 2-{[(4-iodophenyl)sulfonyl]amino}benzoic acid, Thiol:disulfide interchange protein DsbA Authors: Williams, M.L, Doak, B.C, Vazirani, M, Ilyichova, O, Wang, G, Bermel, W, Simpson, J.S, Chalmers, D.K, King, G.F, Mobli, M, Scanlon, M.J. Deposit date: 2016-08-22 Release date: 2017-02-08 Last modified: 2024-05-15 Method: SOLUTION NMR Cite: Determination of ligand binding modes in weak protein-ligand complexes using sparse NMR data. J.Biomol.Nmr, 66, 2016

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