PDB: 30805 resultsInfo pagesStatus searchChemie searchBIRD

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8PIP	DNA triplex structure with Polypyridyl Ruthenium Complexes Descriptor: CHLORIDE ION, DNA (31-MER), Delta-Ru(phen)2(dppz) complex, ... Authors: Abdullrahman, A, Cardin, C.J, Hall, J.P. Deposit date: 2023-06-22 Release date: 2024-07-10 Last modified: 2024-07-24 Method: X-RAY DIFFRACTION (2 Å) Cite: DNA triplex structure with bound ruthenium polypyridyl complexes To Be Published
7OBF	Crystal structure of the human VH antibody domain HEL4 Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, GLYCEROL, HEL4, ... Authors: Belviso, B.D, Caliandro, R, Carrozzini, B. Deposit date: 2021-04-22 Release date: 2021-05-05 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (2.699 Å) Cite: Crystal structure of the human VH antibody domain HEL4 To Be Published
6N9T	Structure of a peptide-based photo-affinity cross-linker with Herceptin Fc Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-6)-[alpha-D-mannopyranose-(1-3)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-2)-alpha-D-mannopyranose-(1-6)-[alpha-D-mannopyranose-(1-3)]beta-D-mannopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[beta-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, Immunoglobulin G1 FC, ... Authors: Sadowsky, J, Ultsch, M, Vance, N, Wang, W. Deposit date: 2018-12-04 Release date: 2019-01-16 Last modified: 2020-07-29 Method: X-RAY DIFFRACTION (2.576 Å) Cite: Development, Optimization, and Structural Characterization of an Efficient Peptide-Based Photoaffinity Cross-Linking Reaction for Generation of Homogeneous Conjugates from Wild-Type Antibodies. Bioconjug. Chem., 30, 2019
8PJR	Crystal structure of the SAKe6AC-LB protein Descriptor: SAKe6AC-LB Authors: Wouters, S.M.L. Deposit date: 2023-06-23 Release date: 2024-07-10 Method: X-RAY DIFFRACTION (1.71 Å) Cite: Computational design of the SAKe scaffold protein To Be Published
7XAY	Crystal structure of Hat1-Hat2-Asf1-H3-H4 Descriptor: COENZYME A, Histone H3, Histone H4, ... Authors: Yue, Y, Yang, W.S, Xu, R.M. Deposit date: 2022-03-19 Release date: 2022-05-18 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (3.3 Å) Cite: Topography of histone H3-H4 interaction with the Hat1-Hat2 acetyltransferase complex. Genes Dev., 36, 2022
6PEA	High Resolution Apo Carbonic Anhydrase II Descriptor: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Carbonic anhydrase 2 Authors: Andring, J.T, McKenna, R. Deposit date: 2019-06-20 Release date: 2020-03-11 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.36 Å) Cite: Structure and mechanism of copper-carbonic anhydrase II: a nitrite reductase. Iucrj, 7, 2020
8PKR	Crystal structure of PknD-345, a repeat fragment from the M. tuberculosis PknD beta-propeller Descriptor: GLYCEROL, non-specific serine/threonine protein kinase Authors: Wouters, S.M.L. Deposit date: 2023-06-27 Release date: 2024-07-10 Method: X-RAY DIFFRACTION (0.95 Å) Cite: Computational design of the SAKe scaffold proteins To Be Published
6B2B	Crystal structure of fluoride channel Fluc Ec2 F83M Mutant Descriptor: DECYL-BETA-D-MALTOPYRANOSIDE, FLUORIDE ION, Fluoride ion transporter CrcB, ... Authors: Last, N.B, Sun, S, Pham, M.C, Miller, C. Deposit date: 2017-09-19 Release date: 2017-10-11 Last modified: 2023-10-04 Method: X-RAY DIFFRACTION (2.6 Å) Cite: Molecular determinants of permeation in a fluoride-specific ion channel. Elife, 6, 2017
7TNG	Kringle domain of human Receptor Tyrosine Kinase-Like Orphan Receptor 1 (ROR1) Descriptor: Inactive tyrosine-protein kinase transmembrane receptor ROR1 Authors: Guarino, S.R, Di Bello, A, Palamini, M, Forneris, F. Deposit date: 2022-01-21 Release date: 2022-05-11 Last modified: 2023-10-18 Method: X-RAY DIFFRACTION (1.4 Å) Cite: Crystal structure of the kringle domain of human receptor tyrosine kinase-like orphan receptor 1 (hROR1) Acta Crystallogr.,Sect.F, 78, 2022
8PMC	transcription factor BARHL2 bound to TAATT DNA sequence Descriptor: BarH-like 2 homeobox protein, DNA Authors: Morgunova, E, Popov, A, Yin, Y, Taipale, J. Deposit date: 2023-06-28 Release date: 2024-07-10 Method: X-RAY DIFFRACTION (1.85 Å) Cite: transcription factor BARHL2 bound to DNA sequences To Be Published
6PEX	An aldo keto reductase with 2-keto- L-gulonate reductase activity Descriptor: aldo keto reductase Authors: Yong, J, Crystal, S, Robert, D.H, John, B.B. Deposit date: 2019-06-21 Release date: 2019-09-11 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.581 Å) Cite: An aldo-keto reductase with 2-keto-l-gulonate reductase activity functions in l-tartaric acid biosynthesis from vitamin C inVitis vinifera. J.Biol.Chem., 294, 2019
8PG5	Crystal structure of the metallo-beta-lactamase VIM1 with 2731 Descriptor: 3-[3-fluoranyl-4-(methylsulfonylmethyl)phenyl]-7-[(1~{S})-1-(piperidin-4-ylmethoxy)ethyl]-1~{H}-indole-2-carboxylic acid, Beta-lactamase VIM-1, ZINC ION Authors: Calvopina, K, Brem, J, Farley, A.J.M, Allen, M.D, Schofield, C.J. Deposit date: 2023-06-18 Release date: 2024-07-10 Method: X-RAY DIFFRACTION (1.25 Å) Cite: Crystal structure of the metallo-beta-lactamase VIM1 with 2731 To Be Published
6MON	Crystal structure of human SMYD2 in complex with Nle-peptide inhibitor Descriptor: GLYCEROL, LYS-LEU-NLE-SER-LYS-ARG-GLY, N-lysine methyltransferase SMYD2, ... Authors: Spellmon, N, Cornett, E, Brunzelle, J, Rothbart, S, Yang, Z. Deposit date: 2018-10-04 Release date: 2018-12-12 Last modified: 2023-11-15 Method: X-RAY DIFFRACTION (2.711 Å) Cite: A functional proteomics platform to reveal the sequence determinants of lysine methyltransferase substrate selectivity. Sci Adv, 4, 2018
6PMZ	Structure of rat neuronal nitric oxide synthase heme domain in complex with 7-(5-(Aminomethyl)pyridin-3-yl)-4-methylquinolin-2-amine Descriptor: 5,6,7,8-TETRAHYDROBIOPTERIN, 7-[5-(aminomethyl)pyridin-3-yl]-4-methylquinolin-2-amine, ACETATE ION, ... Authors: Li, H, Poulos, T.L. Deposit date: 2019-07-02 Release date: 2020-04-29 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (2.1 Å) Cite: First Contact: 7-Phenyl-2-Aminoquinolines, Potent and Selective Neuronal Nitric Oxide Synthase Inhibitors That Target an Isoform-Specific Aspartate. J.Med.Chem., 63, 2020
7P9C	Escherichia coli type II L-asparaginase Descriptor: L-asparaginase 2 Authors: Maggi, M, Scotti, C. Deposit date: 2021-07-27 Release date: 2021-10-20 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (1.6 Å) Cite: Revealing Escherichia coli type II L-asparaginase active site flexible loop in its open, ligand-free conformation. Sci Rep, 11, 2021
8PG6	Crystal structure of the metallo-beta-lactamase VIM1 with 2754 Descriptor: 7-[(1~{S})-1-[3-(3-azanylpropyl)-2,5-bis(oxidanylidene)imidazolidin-1-yl]ethyl]-3-[3-fluoranyl-4-(methylsulfonylmethyl)phenyl]-1~{H}-indole-2-carboxylic acid, Beta-lactamase VIM-1, ZINC ION Authors: Calvopina, K, Brem, J, Farley, A.J.M, Allen, M.D, Schofield, C.J. Deposit date: 2023-06-18 Release date: 2024-07-10 Method: X-RAY DIFFRACTION (1.2 Å) Cite: Crystal structure of the metallo-beta-lactamase VIM1 with 2754 To Be Published
7X4O	Crystal structure of Vps17p PX from S. cerevisiae (Space) Descriptor: SULFATE ION, Vacuolar protein sorting-associated protein 17 Authors: Maita, N, Kohda, D, Obita, T. Deposit date: 2022-03-03 Release date: 2022-05-18 Last modified: 2024-04-03 Method: X-RAY DIFFRACTION (2.02 Å) Cite: Crystal structure of the PX domain of Vps17p from Saccharomyces cerevisiae. Acta Crystallogr.,Sect.F, 78, 2022
6MYF	Crystal structure of free human Scribble PDZ1 domain Descriptor: Protein scribble homolog Authors: Sun, Y.J, Hou, T, Gakhar, L, Fuentes, E.J. Deposit date: 2018-11-01 Release date: 2019-04-10 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.6 Å) Cite: SGEF forms a complex with Scribble and Dlg1 and regulates epithelial junctions and contractility. J.Cell Biol., 218, 2019
8PGM	Crystal structure of the metallo-beta-lactamase VIM1 with 3062 Descriptor: 3-[4-[(azanyl-methyl-oxidanyl-$l^{4}-sulfanyl)methyl]-3-fluoranyl-phenyl]-7-propan-2-yl-1~{H}-indole-2-carboxylic acid, Beta-lactamase VIM-1, DIMETHYL SULFOXIDE, ... Authors: Calvopina, K, Brem, J, Farley, A.J.M, Allen, M.D, Schofield, C.J. Deposit date: 2023-06-18 Release date: 2024-07-10 Method: X-RAY DIFFRACTION (1.27 Å) Cite: Crystal structure of the metallo-beta-lactamase VIM1 with 3062 To Be Published
7X7O	SARS-CoV-2 spike RBD in complex with neutralizing antibody UT28K Descriptor: Spike protein S1, UT28K Fab, heavy chain, ... Authors: Ozawa, T, Tani, H, Anraku, Y, Kita, S, Igarashi, E, Saga, Y, Inasaki, N, Kawasuji, H, Yamada, H, Sasaki, S, Somekawa, M, Sasaki, J, Hayakawa, Y, Yamamoto, Y, Morinaga, Y, Kurosawa, N, Isobe, M, Fukuhara, H, Maenaka, K, Hashiguchi, T, Kishi, H, Kitajima, I, Saito, S, Niimi, H. Deposit date: 2022-03-10 Release date: 2022-05-25 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (3.75 Å) Cite: Novel super-neutralizing antibody UT28K is capable of protecting against infection from a wide variety of SARS-CoV-2 variants. Mabs, 14, 2022
8PGI	Crystal structure of the metallo-beta-lactamase VIM1 with 2984 Descriptor: 7-[(1~{S})-1-[5-[(3-azanyl-3-methyl-azetidin-1-yl)methyl]-2-oxidanylidene-1,3-oxazolidin-3-yl]ethyl]-3-[3-fluoranyl-4-(methylsulfonylmethyl)phenyl]-1~{H}-indole-2-carboxylic acid, Beta-lactamase VIM-1, ZINC ION Authors: Calvopina, K, Brem, J, Farley, A.J.M, Allen, M.D, Schofield, C.J. Deposit date: 2023-06-18 Release date: 2024-07-10 Method: X-RAY DIFFRACTION (1.4 Å) Cite: Crystal structure of the metallo-beta-lactamase VIM1 with 2984 To Be Published
6PNB	Structure of human neuronal nitric oxide synthase R354A/G357D mutant heme domain in complex with 7-(4-(Aminomethyl)phenyl)-4-methylquinolin-2-amine Descriptor: 5,6,7,8-TETRAHYDROBIOPTERIN, 7-[4-(aminomethyl)phenyl]-4-methylquinolin-2-amine, GLYCEROL, ... Authors: Li, H, Poulos, T.L. Deposit date: 2019-07-02 Release date: 2020-04-29 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (2.05 Å) Cite: First Contact: 7-Phenyl-2-Aminoquinolines, Potent and Selective Neuronal Nitric Oxide Synthase Inhibitors That Target an Isoform-Specific Aspartate. J.Med.Chem., 63, 2020
8PGY	Crystal structure of the metallo-beta-lactamase VIM1 with 3462 Descriptor: 7-[(1~{S})-1-[2-(aminomethyl)-6-oxidanylidene-5-oxa-7-azaspiro[3.4]octan-7-yl]ethyl]-3-(6-methoxy-5-oxidanyl-pyridin-3-yl)-1~{H}-indole-2-carboxylic acid, Beta-lactamase VIM-1, ZINC ION Authors: Calvopina, K, Brem, J, Farley, A.J.M, Allen, M.D, Schofield, C.J. Deposit date: 2023-06-18 Release date: 2024-07-10 Method: X-RAY DIFFRACTION (1.34 Å) Cite: Crystal structure of the metallo-beta-lactamase VIM1 with 3462 To Be Published
6PNO	Human GSTO1-1 complexed with 2-chloro-N-(4-chloro-3-(N-isopropylsulfamoyl)phenyl)acetamide Descriptor: 2-chloro-N-{4-chloro-3-[(propan-2-yl)sulfamoyl]phenyl}acetamide, Glutathione S-transferase omega-1, L(+)-TARTARIC ACID, ... Authors: Oakley, A.J. Deposit date: 2019-07-02 Release date: 2019-07-24 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.82 Å) Cite: Development of Benzenesulfonamide Derivatives as Potent Glutathione Transferase Omega-1 Inhibitors. J.Med.Chem., 63, 2020
8PGZ	Crystal structure of the metallo-beta-lactamase VIM1 with 3528 Descriptor: 7-[(1~{S})-1-[2-(aminomethyl)-6-oxidanylidene-5-oxa-7-azaspiro[3.4]octan-7-yl]ethyl]-3-(6-oxidanylidene-1~{H}-pyridazin-4-yl)-1~{H}-indole-2-carboxylic acid, Beta-lactamase VIM-1, ZINC ION Authors: Calvopina, K, Brem, J, Farley, A.J.M, Allen, M.D, Schofield, C.J. Deposit date: 2023-06-18 Release date: 2024-07-10 Method: X-RAY DIFFRACTION (1.34 Å) Cite: Crystal structure of the metallo-beta-lactamase VIM1 with 3528 To Be Published

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