PDB: 225399 resultsInfo pagesStatus searchChemie searchBIRD

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6ZQX	Crystal structure of tetrameric fibrinogen-like recognition domain of FIBCD1 with N,N'-diacetyl chitobiose ligand bound Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose, ACETIC ACID, CALCIUM ION, ... Authors: Shrive, A.K, Greenhough, T.J, Williams, H.M. Deposit date: 2020-07-10 Release date: 2021-07-21 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (1.84 Å) Cite: Crystal structures of human immune protein FIBCD1 suggest an extended binding site compatible with recognition of pathogen associated carbohydrate motifs J.Biol.Chem., 2023
6ZR0	Crystal structure of tetrameric fibrinogen-like recognition domain of FIBCD1 with N-acetylalanine ligand bound Descriptor: ACETIC ACID, CALCIUM ION, Fibrinogen C domain-containing protein 1, ... Authors: Shrive, A.K, Greenhough, T.J, Williams, H.M. Deposit date: 2020-07-10 Release date: 2021-07-21 Last modified: 2024-01-31 Method: X-RAY DIFFRACTION (1.94 Å) Cite: Crystal structures of human immune protein FIBCD1 suggest an extended binding site compatible with recognition of pathogen associated carbohydrate motifs J.Biol.Chem., 2023
6YQQ	ForT-PRPP complex Descriptor: 1-O-pyrophosphono-5-O-phosphono-alpha-D-ribofuranose, CHLORIDE ION, ForT-PRPP complex, ... Authors: Naismith, J.H, Gao, S. Deposit date: 2020-04-18 Release date: 2020-05-20 Last modified: 2024-05-01 Method: X-RAY DIFFRACTION (2.5 Å) Cite: Uncovering the chemistry of C-C bond formation in C-nucleoside biosynthesis: crystal structure of a C-glycoside synthase/PRPP complex. Chem.Commun.(Camb.), 56, 2020
6OXA	Dimeric E.coli YoeB bound to Thermus thermophilus 70S pre-cleavage (AAU) Descriptor: 16S rRNA, 23S rRNA, 30S ribosomal protein S10, ... Authors: Pavelich, I.J, Hoffer, E.D, Maehigashi, T, Dunham, C.M. Deposit date: 2019-05-13 Release date: 2019-08-21 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (3.25 Å) Cite: Monomeric YoeB toxin retains RNase activity but adopts an obligate dimeric form for thermal stability. Nucleic Acids Res., 47, 2019
5UI2	CRYSTAL STRUCTURE OF ORANGE CAROTENOID PROTEIN Descriptor: (3'R)-3'-hydroxy-beta,beta-caroten-4-one, CHLORIDE ION, Orange carotenoid-binding protein, ... Authors: KERFELD, C.A, SAWAYA, M.R, VISHNU, B, KROGMANN, D, YEATES, T.O. Deposit date: 2017-01-12 Release date: 2017-01-25 Last modified: 2024-03-06 Method: X-RAY DIFFRACTION (2.1 Å) Cite: The crystal structure of a cyanobacterial water-soluble carotenoid binding protein. Structure, 11, 2003
6P11	Structure of spastin AAA domain (T692A mutant) in complex with JNJ-7706621 inhibitor Descriptor: (4S)-2-METHYL-2,4-PENTANEDIOL, 4-({5-amino-1-[(2,6-difluorophenyl)carbonyl]-1H-1,2,4-triazol-3-yl}amino)benzenesulfonamide, Drosophila melanogaster Spastin AAA domain, ... Authors: Pisa, R, Cupido, T, Kapoor, T.M. Deposit date: 2019-05-17 Release date: 2019-07-24 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (2.15 Å) Cite: Analyzing Resistance to Design Selective Chemical Inhibitors for AAA Proteins. Cell Chem Biol, 26, 2019
8C4W	Crystal structure of rat autotaxin and compound MEY-002 Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 5,7-bis(oxidanyl)-2-[1-(phenylmethyl)indol-3-yl]chromen-4-one, 7alpha-hydroxycholesterol, ... Authors: Eymery, M.C, McCarthy, A.A. Deposit date: 2023-01-05 Release date: 2023-11-22 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (1.95 Å) Cite: Discovery of potent chromone-based autotaxin inhibitors inspired by cannabinoids. Eur.J.Med.Chem., 263, 2023
6P1F	apo PmoF2 PCuAC domain Descriptor: Copper chaperone PCu(A)C Authors: Fisher, O.S, Sendzik, M.R, Rosenzweig, A.C. Deposit date: 2019-05-19 Release date: 2019-09-25 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.654 Å) Cite: PCuAC domains from methane-oxidizing bacteria use a histidine brace to bind copper. J.Biol.Chem., 294, 2019
8C7R	Crystal structure of rat autotaxin and compound MEY-003 Descriptor: 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, 5,7-bis(oxidanyl)-2-(1-pentylindol-3-yl)chromen-4-one, 7alpha-hydroxycholesterol, ... Authors: Eymery, M.C, McCarthy, A.A. Deposit date: 2023-01-17 Release date: 2023-11-22 Last modified: 2023-11-29 Method: X-RAY DIFFRACTION (2.53 Å) Cite: Discovery of potent chromone-based autotaxin inhibitors inspired by cannabinoids. Eur.J.Med.Chem., 263, 2023
6P4Y	Crystal Structure of anti-IL-7Ralpha 4A10 Fab Descriptor: 4A10 Fab heavy chain, 4A10 Fab light chain Authors: Walsh, S.T.R, Kashi, L, Kohnhorst, C.L. Deposit date: 2019-05-29 Release date: 2019-09-04 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (1.799 Å) Cite: New anti-IL-7R alpha monoclonal antibodies show efficacy against T cell acute lymphoblastic leukemia in pre-clinical models. Leukemia, 34, 2020
6P7J	Crystal structure of Latency Associated Peptide unbound to TGF-beta1 Descriptor: Transforming growth factor beta-1 proprotein Authors: Stachowski, T.R, Snell, M.E, Snell, E.H. Deposit date: 2019-06-05 Release date: 2020-03-11 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (3.501 Å) Cite: Structural insights into conformational switching in latency-associated peptide between transforming growth factor beta-1 bound and unbound states Iucrj, 7, 2020
6P5L	Crystal Structure of Ubl123 with an EZH2 peptide Descriptor: PRO-ARG-LYS-LYS-LYS-ARG-LYS-HIS, Ubiquitin carboxyl-terminal hydrolase 7 Authors: Saridakis, V. Deposit date: 2019-05-30 Release date: 2020-05-06 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (3.296 Å) Cite: Structural Basis of the Interaction Between Ubiquitin Specific Protease 7 and Enhancer of Zeste Homolog 2. J.Mol.Biol., 432, 2020
6PAM	Structure of a bacterial Atm1-family ABC transporter with MgADP bound Descriptor: ADENOSINE-5'-DIPHOSPHATE, ATM1-type heavy metal exporter, MAGNESIUM ION Authors: Fan, C, Kaiser, J.T, Rees, D.C. Deposit date: 2019-06-11 Release date: 2020-06-24 Last modified: 2023-10-11 Method: X-RAY DIFFRACTION (3.7 Å) Cite: A structural framework for unidirectional transport by a bacterial ABC exporter. Proc.Natl.Acad.Sci.USA, 117, 2020
6OZJ	Crystal structure of Mus musculus (Mm) Endonuclease V in complex with a 23mer RNA oligo containing an inosine in the absence of divalent cation Descriptor: 1,2-ETHANEDIOL, DNA/RNA (5'-R(P*CP*GP*GP*UP*AP*AP*CP*CP*C)-D(P*I)-R(P*AP*UP*AP*UP*GP*CP*AP*UP*GP*CP*AP*UP*U)-3'), Endonuclease V, ... Authors: Samara, N.L, Yang, W. Deposit date: 2019-05-15 Release date: 2019-09-04 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (2.247 Å) Cite: Evolution of Inosine-Specific Endonuclease V from Bacterial DNase to Eukaryotic RNase. Mol.Cell, 76, 2019
6OZQ	Crystal structure of Mus musculus (Mm) Endonuclease V (K155M) in complex with a 23mer RNA oligo containing an inosine after a 100 min soak in 10 mM Mn2+ and K+ Descriptor: 1,2-ETHANEDIOL, DNA/RNA (5'-R(P*CP*GP*GP*UP*AP*AP*CP*CP*C)-D(P*I)-R(P*AP*UP*AP*UP*GP*CP*AP*UP*GP*CP*AP*UP*U)-3'), Endonuclease V, ... Authors: Samara, N.L, Yang, W. Deposit date: 2019-05-15 Release date: 2019-09-04 Last modified: 2024-03-13 Method: X-RAY DIFFRACTION (2.153 Å) Cite: Evolution of Inosine-Specific Endonuclease V from Bacterial DNase to Eukaryotic RNase. Mol.Cell, 76, 2019
8C40	14-3-3sigma bound to PKA-responsive ERa phosphopeptide Descriptor: 14-3-3 protein sigma, Estrogen Receptor alpha phosphopeptide, MAGNESIUM ION Authors: Somsen, B.A, Ottmann, C. Deposit date: 2022-12-30 Release date: 2023-12-27 Method: X-RAY DIFFRACTION (1.4 Å) Cite: Molecular basis and dual ligand regulation of tetrameric estrogen receptor alpha /14-3-3 zeta protein complex. J.Biol.Chem., 299, 2023
8C43	Ternary structure of 14-3-3sigma, strep-tagged PKA-responsive ERa phosphopeptide, and Fusicoccin-A. Descriptor: 14-3-3 protein sigma, De-acetylated Fusicoccin, Estrogen Receptor alpha phosphopeptide, ... Authors: Somsen, B.A, Ottmann, C. Deposit date: 2022-12-30 Release date: 2023-12-27 Method: X-RAY DIFFRACTION (1.4 Å) Cite: Molecular basis and dual ligand regulation of tetrameric estrogen receptor alpha /14-3-3 zeta protein complex. J.Biol.Chem., 299, 2023
8C14	Aurora A kinase in complex with TPX2-inhibitor 9 Descriptor: (1~{R},2~{R})-cyclohexane-1,2-dicarboxylic acid, 4-(4-chloranyl-3-cyano-phenyl)-1~{H}-indole-6-carboxylic acid, ACETATE ION, ... Authors: Fischer, G, Rocaboy, M, Blaszczyk, B, Moschetti, T, Wang, X, Scott, D.E, Coyne, A.G, Dagostin, C, Rooney, T, Bayly, A, Feng, J, Asteian, A, Alcaide-Lopez, A, Stockwell, S, Skidmore, J, Venkitaraman, A.R, Abell, C, Blundell, T.L, Hyvonen, M. Deposit date: 2022-12-20 Release date: 2024-01-10 Last modified: 2024-09-25 Method: X-RAY DIFFRACTION (1.93 Å) Cite: Selective Aurora A-TPX2 Interaction Inhibitors Have In Vivo Efficacy as Targeted Antimitotic Agents. J.Med.Chem., 67, 2024
8C1D	Aurora A kinase in complex with TPX2-inhibitor 9 Descriptor: (1~{R},2~{R})-cyclohexane-1,2-dicarboxylic acid, 4-(4-chlorophenyl)-7-methyl-1~{H}-indole-6-carboxylic acid, ACETATE ION, ... Authors: Fischer, G, Rocaboy, M, Blaszczyk, B, Moschetti, T, Wang, X, Scott, D.E, Coyne, A.G, Dagostin, C, Rooney, T, Bayly, A, Feng, J, Asteian, A, Alcaide-Lopez, A, Stockwell, S, Skidmore, J, Venkitaraman, A.R, Abell, C, Blundell, T.L, Hyvonen, M. Deposit date: 2022-12-20 Release date: 2024-01-10 Last modified: 2024-09-25 Method: X-RAY DIFFRACTION (2.115 Å) Cite: Selective Aurora A-TPX2 Interaction Inhibitors Have In Vivo Efficacy as Targeted Antimitotic Agents. J.Med.Chem., 67, 2024
8C1H	Aurora A kinase in complex with TPX2-inhibitor 8 Descriptor: (1~{R},2~{R})-cyclohexane-1,2-dicarboxylic acid, 4-(4-chloranyl-3-pyrazin-2-yloxy-phenyl)-~{N}-(dimethylsulfamoyl)-7-methyl-1~{H}-indole-6-carboxamide, ACETATE ION, ... Authors: Fischer, G, Rocaboy, M, Blaszczyk, B, Moschetti, T, Wang, X, Scott, D.E, Coyne, A.G, Dagostin, C, Rooney, T, Bayly, A, Feng, J, Asteian, A, Alcaide-Lopez, A, Stockwell, S, Skidmore, J, Venkitaraman, A.R, Abell, C, Blundell, T.L, Hyvonen, M. Deposit date: 2022-12-20 Release date: 2024-01-10 Last modified: 2024-09-25 Method: X-RAY DIFFRACTION (2.233 Å) Cite: Selective Aurora A-TPX2 Interaction Inhibitors Have In Vivo Efficacy as Targeted Antimitotic Agents. J.Med.Chem., 67, 2024
8C3Z	14-3-3sigma bound to strep-tagged PKA-responsive ERa phosphopeptide Descriptor: 14-3-3 protein sigma, Estrogen receptor, MAGNESIUM ION Authors: Somsen, B.A, Ottmann, C. Deposit date: 2022-12-30 Release date: 2023-12-27 Method: X-RAY DIFFRACTION (1.4 Å) Cite: Molecular basis and dual ligand regulation of tetrameric estrogen receptor alpha /14-3-3 zeta protein complex. J.Biol.Chem., 299, 2023
8C15	Aurora A kinase in complex with TPX2-inhibitor 3 Descriptor: (1~{R},2~{R})-cyclohexane-1,2-dicarboxylic acid, 4-(4-chlorophenyl)-1~{H}-indole-6-carboxylic acid, ACETATE ION, ... Authors: Fischer, G, Rocaboy, M, Blaszczyk, B, Moschetti, T, Wang, X, Scott, D.E, Coyne, A.G, Dagostin, C, Rooney, T, Bayly, A, Feng, J, Asteian, A, Alcaide-Lopez, A, Stockwell, S, Skidmore, J, Venkitaraman, A.R, Abell, C, Blundell, T.L, Hyvonen, M. Deposit date: 2022-12-20 Release date: 2024-01-10 Last modified: 2024-09-25 Method: X-RAY DIFFRACTION (2.41 Å) Cite: Selective Aurora A-TPX2 Interaction Inhibitors Have In Vivo Efficacy as Targeted Antimitotic Agents. J.Med.Chem., 67, 2024
8C1E	Aurora A kinase in complex with TPX2-inhibitor 9 Descriptor: 4-(4-chloranyl-3-cyano-phenyl)-7-methyl-1~{H}-indole-6-carboxylic acid, ADENOSINE-5'-TRIPHOSPHATE, Aurora kinase A, ... Authors: Fischer, G, Rocaboy, M, Blaszczyk, B, Moschetti, T, Wang, X, Scott, D.E, Coyne, A.G, Dagostin, C, Rooney, T, Bayly, A, Feng, J, Asteian, A, Alcaide-Lopez, A, Stockwell, S, Skidmore, J, Venkitaraman, A.R, Abell, C, Blundell, T.L, Hyvonen, M. Deposit date: 2022-12-20 Release date: 2024-01-10 Last modified: 2024-09-25 Method: X-RAY DIFFRACTION (2.798 Å) Cite: Selective Aurora A-TPX2 Interaction Inhibitors Have In Vivo Efficacy as Targeted Antimitotic Agents. J.Med.Chem., 67, 2024
8C1I	Aurora A kinase in complex with TPX2-inhibitor 10 Descriptor: (1~{R},2~{R})-cyclohexane-1,2-dicarboxylic acid, 4-(4-chloranyl-3-pyridin-2-yloxy-phenyl)-~{N}-cyclopropylsulfonyl-7-methyl-1~{H}-indole-6-carboxamide, ACETATE ION, ... Authors: Fischer, G, Rocaboy, M, Blaszczyk, B, Moschetti, T, Wang, X, Scott, D.E, Coyne, A.G, Dagostin, C, Rooney, T, Bayly, A, Feng, J, Asteian, A, Alcaide-Lopez, A, Stockwell, S, Skidmore, J, Venkitaraman, A.R, Abell, C, Blundell, T.L, Hyvonen, M. Deposit date: 2022-12-20 Release date: 2024-01-10 Last modified: 2024-09-25 Method: X-RAY DIFFRACTION (2.81 Å) Cite: Selective Aurora A-TPX2 Interaction Inhibitors Have In Vivo Efficacy as Targeted Antimitotic Agents. J.Med.Chem., 67, 2024
8C1F	Aurora A kinase in complex with TPX2-inhibitor 6 Descriptor: (1~{R},2~{R})-cyclohexane-1,2-dicarboxylic acid, 4-(4-chlorophenyl)-~{N}-cyclopropylsulfonyl-7-methyl-1~{H}-indole-6-carboxamide, ADENOSINE-5'-DIPHOSPHATE, ... Authors: Fischer, G, Rocaboy, M, Blaszczyk, B, Moschetti, T, Wang, X, Scott, D.E, Coyne, A.G, Dagostin, C, Rooney, T, Bayly, A, Feng, J, Asteian, A, Alcaide-Lopez, A, Stockwell, S, Skidmore, J, Venkitaraman, A.R, Abell, C, Blundell, T.L, Hyvonen, M. Deposit date: 2022-12-20 Release date: 2024-01-10 Last modified: 2024-09-25 Method: X-RAY DIFFRACTION (1.924 Å) Cite: Selective Aurora A-TPX2 Interaction Inhibitors Have In Vivo Efficacy as Targeted Antimitotic Agents. J.Med.Chem., 67, 2024

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