PDB: 56562 resultsInfo pagesStatus searchChemie searchBIRD

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6GFA	Structure of Nucleotide binding domain of HSP110, ATP and Mg2+ complexed Descriptor: ADENOSINE-5'-TRIPHOSPHATE, Heat shock protein 105 kDa, MAGNESIUM ION Authors: Gonzalez, D, Gotthard, G, Gozzi, G.J, Seigneuric, R, Neiers, F, Briand, L, Garrido, C. Deposit date: 2018-04-29 Release date: 2019-05-08 Last modified: 2024-01-17 Method: X-RAY DIFFRACTION (2 Å) Cite: Selecting the first chemical molecule inhibitor of HSP110 for colorectal cancer therapy. Cell Death Differ., 27, 2020
6Y2J	Crystal structure of M. tuberculosis KasA in complex with 4,4,4-trifluoro-N-(isoquinolin-6-yl)butane-1-sulfonamide Descriptor: 3-oxoacyl-[acyl-carrier-protein] synthase 1, 4,4,4-tris(fluoranyl)-~{N}-isoquinolin-6-yl-butane-1-sulfonamide, SODIUM ION, ... Authors: Chung, C. Deposit date: 2020-02-16 Release date: 2020-04-08 Last modified: 2024-05-15 Method: X-RAY DIFFRACTION (2.886 Å) Cite: Exploring the SAR of the beta-Ketoacyl-ACP Synthase Inhibitor GSK3011724A and Optimization around a Genotoxic Metabolite. Acs Infect Dis., 6, 2020
8OT9	CTE typeIII tau filament from Guam ALS/PDC Descriptor: Microtubule-associated protein tau Authors: Qi, C, Yang, S, Scheres, S.H.W, Goedert, M. Deposit date: 2023-04-20 Release date: 2024-03-27 Method: ELECTRON MICROSCOPY (3.4 Å) Cite: Tau filaments from amyotrophic lateral sclerosis/parkinsonism-dementia complex adopt the CTE fold. Proc.Natl.Acad.Sci.USA, 120, 2023
6K7M	Cryo-EM structure of the human P4-type flippase ATP8A1-CDC50 (E2Pi-PL state) Descriptor: (2~{S})-2-azanyl-3-[[(2~{R})-3-hexadecanoyloxy-2-[(~{Z})-octadec-9-enoyl]oxy-propoxy]-oxidanyl-phosphoryl]oxy-propanoic acid, 2-acetamido-2-deoxy-beta-D-glucopyranose, CHOLESTEROL HEMISUCCINATE, ... Authors: Hiraizumi, M, Yamashita, K, Nishizawa, T, Nureki, O. Deposit date: 2019-06-07 Release date: 2019-08-28 Last modified: 2021-02-10 Method: ELECTRON MICROSCOPY (2.95 Å) Cite: Cryo-EM structures capture the transport cycle of the P4-ATPase flippase. Science, 365, 2019
8OTG	CTE typeI tau filament from Kii ALS/PDC Descriptor: Microtubule-associated protein tau Authors: Qi, C, Yang, S, Scheres, S.H.W, Goedert, M. Deposit date: 2023-04-20 Release date: 2024-03-27 Method: ELECTRON MICROSCOPY (2.1 Å) Cite: Tau filaments from amyotrophic lateral sclerosis/parkinsonism-dementia complex adopt the CTE fold. Proc.Natl.Acad.Sci.USA, 120, 2023
8OTH	TypeII tau filament from Kii ALS/PDC Descriptor: Microtubule-associated protein tau Authors: Qi, C, Yang, S, Scheres, S.H.W, Goedert, M. Deposit date: 2023-04-20 Release date: 2024-03-27 Method: ELECTRON MICROSCOPY (3.4 Å) Cite: Tau filaments from amyotrophic lateral sclerosis/parkinsonism-dementia complex adopt the CTE fold. Proc.Natl.Acad.Sci.USA, 120, 2023
8OTF	Ab typeII filament from Guam ALS/PDC Descriptor: Amyloid-beta precursor protein Authors: Qi, C, Yang, S, Scheres, S.H.W, Goedert, M. Deposit date: 2023-04-20 Release date: 2024-03-27 Method: ELECTRON MICROSCOPY (3.3 Å) Cite: Tau filaments from amyotrophic lateral sclerosis/parkinsonism-dementia complex adopt the CTE fold. Proc.Natl.Acad.Sci.USA, 120, 2023
5I73	X-ray structure of the ts3 human serotonin transporter complexed with s-citalopram at the central and allosteric sites Descriptor: (1S)-1-[3-(dimethylamino)propyl]-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-5-carbonitrile, 2-acetamido-2-deoxy-beta-D-glucopyranose, 6-AMINOHEXANOIC ACID, ... Authors: Coleman, J.A, Green, E.M, Gouaux, E. Deposit date: 2016-02-16 Release date: 2016-04-13 Last modified: 2023-11-15 Method: X-RAY DIFFRACTION (3.24 Å) Cite: X-ray structures and mechanism of the human serotonin transporter. Nature, 532, 2016
6QU2	Crystal structure of DYRK1A complexed with FC162 inhibitor Descriptor: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, 8-cyclopropyl-2-pyridin-3-yl-[1,3]thiazolo[5,4-f]quinazolin-9-one, DIMETHYL SULFOXIDE, ... Authors: Chaikuad, A, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Besson, T, Knapp, S, Structural Genomics Consortium (SGC) Deposit date: 2019-02-26 Release date: 2020-03-18 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (2.9 Å) Cite: Crystal structure of DYRK1A complexed with FC162 inhibitor To Be Published
6QQ9	Cryogenic temperature structure of the fluorescent protein Cerulean recorded after an accumulated dose of 5.8 MGy Descriptor: CARBON DIOXIDE, Green fluorescent protein Authors: Gotthard, G, Aumonier, S, Royant, A. Deposit date: 2019-02-18 Release date: 2019-06-19 Last modified: 2019-07-31 Method: X-RAY DIFFRACTION (1.82 Å) Cite: Specific radiation damage is a lesser concern at room temperature. Iucrj, 6, 2019
6QQE	Room temperature structure of Hen Egg White Lysozyme recorded after an accumulated dose of 20 kGy Descriptor: CHLORIDE ION, Lysozyme C Authors: Gotthard, G, Aumonier, S, Royant, A. Deposit date: 2019-02-18 Release date: 2019-06-19 Last modified: 2019-07-31 Method: X-RAY DIFFRACTION (1.37 Å) Cite: Specific radiation damage is a lesser concern at room temperature. Iucrj, 6, 2019
8OTC	CTE typeII tau filament from Guam ALS/PDC Descriptor: Microtubule-associated protein tau Authors: Qi, C, Yang, S, Scheres, S.H.W, Goedert, M. Deposit date: 2023-04-20 Release date: 2024-03-27 Method: ELECTRON MICROSCOPY (3.2 Å) Cite: Tau filaments from amyotrophic lateral sclerosis/parkinsonism-dementia complex adopt the CTE fold. Proc.Natl.Acad.Sci.USA, 120, 2023
8OTJ	PHF tau filament from Kii ALS/PDC Descriptor: Microtubule-associated protein tau Authors: Qi, C, Yang, S, Scheres, S.H.W, Goedert, M. Deposit date: 2023-04-20 Release date: 2024-03-27 Method: ELECTRON MICROSCOPY (3.3 Å) Cite: Tau filaments from amyotrophic lateral sclerosis/parkinsonism-dementia complex adopt the CTE fold. Proc.Natl.Acad.Sci.USA, 120, 2023
6KM7	The structural basis for the internal interaction in RBBP5 Descriptor: HEXAETHYLENE GLYCOL, NONAETHYLENE GLYCOL, Retinoblastoma-binding protein 5, ... Authors: Han, J, Li, T, Chen, Y. Deposit date: 2019-07-31 Release date: 2019-10-02 Last modified: 2024-03-27 Method: X-RAY DIFFRACTION (1.801 Å) Cite: The internal interaction in RBBP5 regulates assembly and activity of MLL1 methyltransferase complex. Nucleic Acids Res., 47, 2019
8OT6	CTE typeI tau filament from Guam ALS/PDC Descriptor: Microtubule-associated protein tau Authors: Qi, C, Yang, S, Scheres, S.H.W, Goedert, M. Deposit date: 2023-04-20 Release date: 2024-03-27 Method: ELECTRON MICROSCOPY (2 Å) Cite: Tau filaments from amyotrophic lateral sclerosis/parkinsonism-dementia complex adopt the CTE fold. Proc.Natl.Acad.Sci.USA, 120, 2023
8OTE	TMEM106B Fold I-d filament from Guam ALS/PDC Descriptor: Transmembrane protein 106B Authors: Qi, C, Yang, S, Scheres, S.H.W, Goedert, M. Deposit date: 2023-04-20 Release date: 2024-03-27 Last modified: 2024-10-16 Method: ELECTRON MICROSCOPY (3.6 Å) Cite: Tau filaments from amyotrophic lateral sclerosis/parkinsonism-dementia complex adopt the CTE fold. Proc.Natl.Acad.Sci.USA, 120, 2023
7ZW8	Identification of M4205 a highly selective inhibitor of cKIT mutations for unresectable metastatic or recurrent GIST Descriptor: Mast/stem cell growth factor receptor Kit, ~{N}-[[4-(1-methylpyrazol-4-yl)phenyl]methyl]-6-[7-(3-pyrrolidin-1-ylpropoxy)imidazo[1,2-a]pyridin-3-yl]pyrimidin-4-amine Authors: Graedler, U, Lammens, A. Deposit date: 2022-05-19 Release date: 2023-02-22 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.119 Å) Cite: Identification of M4205─A Highly Selective Inhibitor of KIT Mutations for Treatment of Unresectable Metastatic or Recurrent Gastrointestinal Stromal Tumors. J.Med.Chem., 66, 2023
5II3	The X-ray structure of the adduct formed in the reaction between hen egg white lysozyme and compound 3, a platin(II) compound containing a O, S bidentate ligand Descriptor: CHLORIDE ION, DIMETHYL SULFOXIDE, Lysozyme C, ... Authors: Ferraro, G, Merlino, A. Deposit date: 2016-03-01 Release date: 2016-12-07 Last modified: 2024-01-10 Method: X-RAY DIFFRACTION (1.78 Å) Cite: Platinum(ii) O,S complexes as potential metallodrugs against Cisplatin resistance. Dalton Trans, 45, 2016
8OT7	Crystal structure of an 8-repeat consensus TPR superhelix with Barium Descriptor: BARIUM ION, Consensus tetratricopeptide repeat protein Authors: Liutkus, M, Rojas, A.L, Cortajarena, A.L. Deposit date: 2023-04-20 Release date: 2024-04-24 Method: X-RAY DIFFRACTION (3.3 Å) Cite: Diverse crystalline protein scaffolds through metal-dependent polymorphism. Protein Sci., 33, 2024
7ZY6	Identification of M4205 a highly selective inhibitor of cKIT mutations for unresectable metastatic or recurrent GIST Descriptor: 5-imidazo[1,2-a]pyridin-3-yl-~{N}-[(1~{R})-1-(6-pyrrolidin-1-ylpyridin-3-yl)ethyl]pyridin-3-amine, HUMAN PROTO-ONCOGENE C-KIT Authors: Graedler, U, Lammens, A. Deposit date: 2022-05-24 Release date: 2023-02-22 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (3.09 Å) Cite: Identification of M4205─A Highly Selective Inhibitor of KIT Mutations for Treatment of Unresectable Metastatic or Recurrent Gastrointestinal Stromal Tumors. J.Med.Chem., 66, 2023
8A2W	Room temperature structure of the ground state of AtPhot2LOV2 in space group P212121, as recovered 1620 seconds after light irradiation Descriptor: FLAVIN MONONUCLEOTIDE, Phototropin-2 Authors: Engilberge, S, Caramello, N, Royant, A. Deposit date: 2022-06-06 Release date: 2023-03-29 Last modified: 2024-02-07 Method: X-RAY DIFFRACTION (2.04 Å) Cite: Slow protein dynamics probed by time-resolved oscillation crystallography at room temperature. Iucrj, 9, 2022
6QND	Liquid Application Method for time-resolved Analyses (LAMA) by serial synchrotron crystallography, Xylose Isomerase 60 s timepoint Descriptor: COBALT (II) ION, D-glucose, MAGNESIUM ION, ... Authors: Mehrabi, P, Schulz, E.C, Miller, R.J.D. Deposit date: 2019-02-11 Release date: 2019-10-02 Last modified: 2024-05-15 Method: X-RAY DIFFRACTION (2.001 Å) Cite: Liquid application method for time-resolved analyses by serial synchrotron crystallography. Nat.Methods, 16, 2019
6QNI	Liquid Application Method for time-resolved Analyses (LAMA) by serial synchrotron crystallography, Xylose Isomerase 1.0 s timepoint Descriptor: COBALT (II) ION, MAGNESIUM ION, Xylose isomerase, ... Authors: Mehrabi, P, Schulz, E.C, Miller, R.J.D. Deposit date: 2019-02-11 Release date: 2019-10-02 Last modified: 2024-05-15 Method: X-RAY DIFFRACTION (1.846 Å) Cite: Liquid application method for time-resolved analyses by serial synchrotron crystallography. Nat.Methods, 16, 2019
6YEC	E.coli's Putrescine receptor PotF complexed with Spermine Descriptor: 1,2-ETHANEDIOL, CHLORIDE ION, DI(HYDROXYETHYL)ETHER, ... Authors: Shanmugaratnam, S, Kroeger, P, Hocker, B. Deposit date: 2020-03-24 Release date: 2021-01-20 Last modified: 2024-01-24 Method: X-RAY DIFFRACTION (2.09 Å) Cite: A comprehensive binding study illustrates ligand recognition in the periplasmic binding protein PotF. Structure, 29, 2021
8OK2	Bipartite interaction of TOPBP1 with the GINS complex Descriptor: DNA replication complex GINS protein PSF1, DNA replication complex GINS protein PSF2, DNA replication complex GINS protein PSF3, ... Authors: Day, M, Oliver, A.W, Pearl, L.H. Deposit date: 2023-03-26 Release date: 2024-03-13 Method: ELECTRON MICROSCOPY (4.1 Å) Cite: TopBP1 utilises a bipartite GINS binding mode to support genome replication. Nat Commun, 15, 2024

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