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1TDE	CRYSTAL STRUCTURE OF ESCHERICHIA COLI THIOREDOXIN REDUCTASE REFINED AT 2 ANGSTROM RESOLUTION: IMPLICATIONS FOR A LARGE CONFORMATIONAL CHANGE DURING CATALYSIS Descriptor: FLAVIN-ADENINE DINUCLEOTIDE, THIOREDOXIN REDUCTASE Authors: Waksman, G, Krishna, T.S.R, Williams Junior, C.H, Kuriyan, J. Deposit date: 1994-01-14 Release date: 1994-11-30 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (2.1 Å) Cite: Crystal structure of Escherichia coli thioredoxin reductase refined at 2 A resolution. Implications for a large conformational change during catalysis. J.Mol.Biol., 236, 1994
1JEM	NMR STRUCTURE OF HISTIDINE PHOSPHORYLATED FORM OF THE PHOSPHOCARRIER HISTIDINE CONTAINING PROTEIN FROM BACILLUS SUBTILIS, NMR, 25 STRUCTURES Descriptor: HISTIDINE CONTAINING PROTEIN Authors: Jones, B.E, Rajagopal, P, Klevit, R.E. Deposit date: 1997-04-01 Release date: 1997-07-23 Last modified: 2021-11-03 Method: SOLUTION NMR Cite: Phosphorylation on histidine is accompanied by localized structural changes in the phosphocarrier protein, HPr from Bacillus subtilis. Protein Sci., 6, 1997
7X9F	Crystal structure of actinomycin D-echinomycin-d(AGCGCGT/ACGCGCT) complex Descriptor: 2-CARBOXYQUINOXALINE, DNA (5'-D(P*AP*CP*GP*CP*GP*CP*T)-3'), DNA (5'-D(P*AP*GP*CP*GP*CP*GP*T)-3'), ... Authors: Kao, S.H, Satange, R.B, Hou, M.H. Deposit date: 2022-03-15 Release date: 2022-12-14 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (2.96 Å) Cite: Staggered intercalation of DNA duplexes with base-pair modulation by two distinct drug molecules induces asymmetric backbone twisting and structure polymorphism. Nucleic Acids Res., 50, 2022
1WPA	1.5 Angstrom crystal structure of human occludin fragment 413-522 Descriptor: Occludin Authors: Li, Y, Lavie, A, Fanning, A.S, Anderson, J.M. Deposit date: 2004-09-01 Release date: 2005-09-06 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (1.5 Å) Cite: Structure of the conserved cytoplasmic C-terminal domain of occludin: identification of the ZO-1 binding surface. J.Mol.Biol., 352, 2005
8EFY	Structure of double homo-hexameric AAA+ ATPase RuvB motors Descriptor: ADENOSINE-5'-DIPHOSPHATE, Holliday junction ATP-dependent DNA helicase RuvB, MAGNESIUM ION, ... Authors: Shen, Z.F, Rish, A.D, Fu, T.M. Deposit date: 2022-09-10 Release date: 2023-05-10 Method: ELECTRON MICROSCOPY (3.16 Å) Cite: Structure of double homo-hexameric AAA+ ATPase RuvB motor binding with DNA substrate To Be Published
7TDM	CryoEM Structure of sFab COP-2 Complex with human claudin-4 and Clostridium perfringens enterotoxin C-terminal domain Descriptor: COP-2 Fab Heavy chain, COP-2 Fab Light chain, Claudin-4, ... Authors: Vecchio, A.J. Deposit date: 2022-01-01 Release date: 2022-02-09 Last modified: 2024-01-17 Method: ELECTRON MICROSCOPY (6.9 Å) Cite: Development, structure, and mechanism of synthetic antibodies that target claudin and Clostridium perfringens enterotoxin complexes. J.Biol.Chem., 298, 2022
7TDN	CryoEM Structure of sFab COP-3 Complex with human claudin-4 and Clostridium perfringens enterotoxin C-terminal domain Descriptor: COP-3 Fab Heavy chain, COP-3 Fab Light chain, Claudin-4, ... Authors: Vecchio, A.J. Deposit date: 2022-01-01 Release date: 2022-02-09 Last modified: 2024-01-17 Method: ELECTRON MICROSCOPY (5 Å) Cite: Development, structure, and mechanism of synthetic antibodies that target claudin and Clostridium perfringens enterotoxin complexes. J.Biol.Chem., 298, 2022
1XAW	crystal structure of the cytoplasmic distal C-terminal domain of occludin Descriptor: Occludin Authors: Li, Y, Fanning, A.S, Anderson, J.M, Lavie, A. Deposit date: 2004-08-26 Release date: 2005-09-06 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (1.45 Å) Cite: Structure of the Conserved Cytoplasmic C-terminal Domain of Occludin: Identification of the ZO-1 Binding Surface. J.Mol.Biol., 352, 2005
1UWB	TYR 181 CYS HIV-1 RT/8-CL TIBO Descriptor: 5-CHLORO-8-METHYL-7-(3-METHYL-BUT-2-ENYL)-6,7,8,9-TETRAHYDRO-2H-2,7,9A-TRIAZA-BENZO[CD]AZULENE-1-THIONE, REVERSE TRANSCRIPTASE Authors: Das, K, Ding, J, Hsiou, Y, Arnold, E. Deposit date: 1996-11-21 Release date: 1997-05-15 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (3.2 Å) Cite: Crystal structures of 8-Cl and 9-Cl TIBO complexed with wild-type HIV-1 RT and 8-Cl TIBO complexed with the Tyr181Cys HIV-1 RT drug-resistant mutant. J.Mol.Biol., 264, 1996
3KZE	Crystal Structure of T-cell Lymphoma Invasion and Metastasis-1 PDZ in Complex With SSRKEYYA Peptide Descriptor: Synthetic Peptide, T-lymphoma invasion and metastasis-inducing protein 1 Authors: Shepherd, T.R, Fuentes, E.J. Deposit date: 2009-12-08 Release date: 2010-04-21 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.8 Å) Cite: The Tiam1 PDZ domain couples to Syndecan1 and promotes cell-matrix adhesion. J.Mol.Biol., 398, 2010
3KZD	Crystal Structure of Free T-cell Lymphoma Invasion and Metastasis-1 PDZ Domain Descriptor: T-lymphoma invasion and metastasis-inducing protein 1 Authors: Shepherd, T.R, Fuentes, E.J. Deposit date: 2009-12-08 Release date: 2010-04-21 Last modified: 2024-02-21 Method: X-RAY DIFFRACTION (1.3 Å) Cite: The Tiam1 PDZ domain couples to Syndecan1 and promotes cell-matrix adhesion. J.Mol.Biol., 398, 2010
4IGG	Full-length human alpha-catenin crystal structure Descriptor: Catenin alpha-1, PHOSPHATE ION Authors: Izard, T, Rangarajan, E.S. Deposit date: 2012-12-17 Release date: 2012-12-26 Last modified: 2024-02-28 Method: X-RAY DIFFRACTION (3.66 Å) Cite: Dimer asymmetry defines alpha-catenin interactions. Nat.Struct.Mol.Biol., 20, 2013
1BR3	CRYSTAL STRUCTURE OF AN 82-NUCLEOTIDE RNA-DNA COMPLEX FORMED BY THE 10-23 DNA ENZYME Descriptor: DNA (10-23 DNA ENZYME), RNA (5'-R(*GP*GP*AP*CP*AP*GP*AP*UP*GP*GP*GP*AP*G)-3') Authors: Nowakowski, J, Shim, P.J, Prasad, G.S, Stout, C.D, Joyce, G.F. Deposit date: 1998-08-13 Release date: 1999-02-23 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (3 Å) Cite: Crystal structure of an 82-nucleotide RNA-DNA complex formed by the 10-23 DNA enzyme. Nat.Struct.Biol., 6, 1999
1PVR	BASIS FOR A SWITCH IN SUBSTRATE SPECIFICITY: CRYSTAL STRUCTURE OF SELECTED VARIANT OF CRE SITE-SPECIFIC RECOMBINASE, LNSGG BOUND TO THE LOXP (WILDTYPE) RECOGNITION SITE Descriptor: 34-MER, Recombinase CRE Authors: Baldwin, E.P, Martin, S.S, Abel, J, Gelato, K.A, Kim, H, Schultz, P.G, Santoro, S.W. Deposit date: 2003-06-28 Release date: 2004-02-17 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (2.65 Å) Cite: A specificity switch in selected cre recombinase variants is mediated by macromolecular plasticity and water. Chem.Biol., 10, 2003
1PVP	BASIS FOR A SWITCH IN SUBSTRATE SPECIFICITY: CRYSTAL STRUCTURE OF SELECTED VARIANT OF CRE SITE-SPECIFIC RECOMBINASE, ALSHG BOUND TO THE ENGINEERED RECOGNITION SITE LOXM7 Descriptor: 34-MER, Recombinase cre Authors: Baldwin, E.P, Martin, S.S, Abel, J, Gelato, K.A, Kim, H, Schultz, P.G, Santoro, S.W. Deposit date: 2003-06-28 Release date: 2004-02-17 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (2.35 Å) Cite: A specificity switch in selected cre recombinase variants is mediated by macromolecular plasticity and water. Chem.Biol., 10, 2003
1PVQ	BASIS FOR A SWITCH IN SUBSTRATE SPECIFICITY: CRYSTAL STRUCTURE OF SELECTED VARIANT OF CRE SITE-SPECIFIC RECOMBINASE, LNSGG BOUND TO THE ENGINEERED RECOGNITION SITE LOXM7 Descriptor: DNA 34-MER, Recombinase cre Authors: Baldwin, E.P, Martin, S.S, Abel, J, Gelato, K.A, Kim, H, Schultz, P.G, Santoro, S.W. Deposit date: 2003-06-28 Release date: 2004-02-17 Last modified: 2023-08-16 Method: X-RAY DIFFRACTION (2.75 Å) Cite: A specificity switch in selected cre recombinase variants is mediated by macromolecular plasticity and water. Chem.Biol., 10, 2003
4EHP	Crystal Structure of human vinculin head domain (residues 1-252) in complex with alpha-catenin (residues 277-382) Descriptor: ACETATE ION, Catenin alpha-1, Vinculin Authors: Izard, T, Rangarajan, E.S. Deposit date: 2012-04-03 Release date: 2012-04-18 Last modified: 2023-09-13 Method: X-RAY DIFFRACTION (2.66 Å) Cite: alpha-Catenin unfurls upon binding to vinculin J.Biol.Chem., 287, 2012
6UZK	Crystal Structure of the Ternary Complex of KRIT1 bound to both the Rap1 GTPase and HKi6 Descriptor: 2-hydroxy-6-methoxynaphthalene-1-carbaldehyde, Krev interaction trapped protein 1, MAGNESIUM ION, ... Authors: Gingras, A.R. Deposit date: 2019-11-15 Release date: 2020-11-18 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.924 Å) Cite: Inhibition of the HEG1-KRIT1 interaction increases KLF4 and KLF2 expression in endothelial cells. Faseb Bioadv, 3, 2021
1OO0	Crystal structure of the Drosophila Mago nashi-Y14 complex Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, BETA-MERCAPTOETHANOL, CG8781-PA, ... Authors: Shi, H, Xu, R.M. Deposit date: 2003-03-02 Release date: 2003-05-27 Last modified: 2024-02-14 Method: X-RAY DIFFRACTION (1.85 Å) Cite: Crystal structure of the Drosophila Mago nashi-Y14 complex Genes Dev., 17, 2003
3EST	STRUCTURE OF NATIVE PORCINE PANCREATIC ELASTASE AT 1.65 ANGSTROMS RESOLUTION Descriptor: CALCIUM ION, PORCINE PANCREATIC ELASTASE, SULFATE ION Authors: Meyer, E.F, Cole, G, Radhakrishnan, R, Epp, O. Deposit date: 1987-09-17 Release date: 1988-01-16 Last modified: 2024-06-05 Method: X-RAY DIFFRACTION (1.65 Å) Cite: Structure of native porcine pancreatic elastase at 1.65 A resolutions. Acta Crystallogr.,Sect.B, 44, 1988
5FX2	COMPARISON OF THE CRYSTAL STRUCTURES OF A FLAVODOXIN IN ITS THREE OXIDATION STATES AT CRYOGENIC TEMPERATURES Descriptor: FLAVIN MONONUCLEOTIDE, FLAVODOXIN Authors: Watt, W, Watenpaugh, K.D. Deposit date: 1991-10-17 Release date: 1993-10-31 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (1.9 Å) Cite: Comparison of the crystal structures of a flavodoxin in its three oxidation states at cryogenic temperatures. J.Mol.Biol., 218, 1991
1DLO	HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 Descriptor: HUMAN IMMUNODEFICIENCY VIRUS TYPE 1 REVERSE TRANSCRIPTASE Authors: Hsiou, Y, Ding, J, Das, K, Hughes, S, Arnold, E. Deposit date: 1996-04-17 Release date: 1996-08-01 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.7 Å) Cite: Structure of unliganded HIV-1 reverse transcriptase at 2.7 A resolution: implications of conformational changes for polymerization and inhibition mechanisms. Structure, 4, 1996
5H5M	Crystal structure of HMP-1 M domain Descriptor: Alpha-catenin-like protein hmp-1 Authors: Kang, H, Bang, I, Weis, W.I, Choi, H.J. Deposit date: 2016-11-08 Release date: 2017-03-29 Last modified: 2024-05-29 Method: X-RAY DIFFRACTION (2.4 Å) Cite: Structural and functional characterization of Caenorhabditis elegans alpha-catenin reveals constitutive binding to beta-catenin and F-actin J. Biol. Chem., 292, 2017
7RN0	Crystal structure of the SARS-CoV-2 (COVID-19) main protease in complex with inhibitor Jun9-57-3R Descriptor: (2R)-2-{acetyl[4-(1H-pyrrol-1-yl)phenyl]amino}-N-[(1S)-1-phenylethyl]-2-(pyridin-3-yl)acetamide, 3C-like proteinase, GLYCEROL Authors: Sacco, M, Chen, Y. Deposit date: 2021-07-28 Release date: 2021-08-11 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (2.25 Å) Cite: Discovery of Di- and Trihaloacetamides as Covalent SARS-CoV-2 Main Protease Inhibitors with High Target Specificity. J.Am.Chem.Soc., 143, 2021
7RN1	Crystal structure of the SARS-CoV-2 (COVID-19) main protease in complex with inhibitor Jun9-62-2R Descriptor: 3C-like proteinase, GLYCEROL, N-([1,1'-biphenyl]-4-yl)-2-chloro-N-[(1R)-2-oxo-2-{[(1S)-1-phenylethyl]amino}-1-(pyridin-3-yl)ethyl]acetamide, ... Authors: Sacco, M, Chen, Y. Deposit date: 2021-07-28 Release date: 2021-09-08 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (2.3 Å) Cite: Discovery of Di- and Trihaloacetamides as Covalent SARS-CoV-2 Main Protease Inhibitors with High Target Specificity. J.Am.Chem.Soc., 143, 2021

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