PDB: 31171 件ウェブページステータス検索Chemie searchBIRD

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6X8F	Crystal structure of TYK2 with Compound 11 分子名称: Non-receptor tyrosine-protein kinase TYK2, [3-{4-[6-(1-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]-1H-pyrazol-1-yl}-1-(2,2,2-trifluoroethyl)azetidin-3-yl]acetonitrile 著者 Vajdos, F.F, Knafels, J.D. 登録日 2020-06-01 公開日 2020-11-25 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (2.15 Å) 主引用文献 Discovery of Tyrosine Kinase 2 (TYK2) Inhibitor (PF-06826647) for the Treatment of Autoimmune Diseases. J.Med.Chem., 63, 2020
6GP6	MamM CTD - Copper form 分子名称: BETA-MERCAPTOETHANOL, COPPER (II) ION, Magnetosome protein MamM 著者 Barber-Zucker, S, Zarivach, R. 登録日 2018-06-05 公開日 2019-06-19 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.146 Å) 主引用文献 MamM CTD - Copper form To Be Published
7B9H	Crystal structure of the PDE4D catalytic domain in complex with GEBR-42a 分子名称: 1,2-ETHANEDIOL, 3-[(~{E})-1-(3-cyclopentyloxy-4-methoxy-phenyl)ethylideneamino]oxy-1-morpholin-4-yl-propan-1-one, MAGNESIUM ION, ... 著者 Torretta, A, Abbate, S, Parisini, E. 登録日 2020-12-14 公開日 2021-06-30 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Design, synthesis, biological evaluation and structural characterization of novel GEBR library PDE4D inhibitors. Eur.J.Med.Chem., 223, 2021
8TR4	Crystal Structure of Mtb Pks13 Thioesterase domain in complex with inhibitor X20404 分子名称: 4-(2-{(4M)-4-[(6M)-6-(2,5-dimethoxyphenyl)pyridin-3-yl]-1H-1,2,3-triazol-1-yl}ethyl)-N,N-dimethylbenzamide, Polyketide synthase Pks13, SULFATE ION 著者 Krieger, I.V, Sacchettini, J.C. 登録日 2023-08-09 公開日 2024-04-24 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Inhibitors of the Thioesterase Activity of Mycobacterium tuberculosis Pks13 Discovered Using DNA-Encoded Chemical Library Screening. Acs Infect Dis., 10, 2024
6OEZ	Crystal structure of Trypanothione Reductase from Trypanosoma brucei in complex with inhibitor (+)-N-(Cyclobutylmethyl)-3-{5-[1-(pyrrolidin-1-yl)cyclohexyl]-2-(1-{[(2S)-pyrro-lidin-2-yl]methyl}-1H-indol-5-yl)-1,3-thiazol-4-yl}prop-2-yn-1-amine 分子名称: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, FLAVIN-ADENINE DINUCLEOTIDE, N-(cyclobutylmethyl)-3-{5-[1-(pyrrolidin-1-yl)cyclohexyl]-2-(1-{[(2S)-pyrrolidin-2-yl]methyl}-1H-indol-5-yl)-1,3-thiazol-4-yl}prop-2-yn-1-amine, ... 著者 Halgas, O, De Gasparo, R, Harangozo, D, Krauth-Siegel, R.L, Diederich, F, Pai, E.F. 登録日 2019-03-28 公開日 2019-07-31 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Targeting a Large Active Site: Structure-Based Design of Nanomolar Inhibitors of Trypanosoma brucei Trypanothione Reductase. Chemistry, 25, 2019
6GY0	mPI3Kd IN COMPLEX WITH AZ3 分子名称: Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, ~{N}-[4-methyl-5-(1-oxidanylidene-7-sulfamoyl-isoindol-5-yl)-1,3-thiazol-2-yl]ethanamide 著者 Petersen, J. 登録日 2018-06-27 公開日 2019-02-06 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (2.55 Å) 主引用文献 A class of highly selective inhibitors bind to an active state of PI3K gamma. Nat.Chem.Biol., 15, 2019
6HTN	Structure of a fucose lectin from Kordia zhangzhouensis in complex with methyl-fucoside 分子名称: (4R)-2-METHYLPENTANE-2,4-DIOL, 1,2-ETHANEDIOL, 3,6,9,12,15,18,21-HEPTAOXATRICOSANE-1,23-DIOL, ... 著者 Varrot, A. 登録日 2018-10-04 公開日 2019-01-23 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 Architecture and Evolution of Blade Assembly in beta-propeller Lectins. Structure, 27, 2019
7ZTW	Crystal Structure of Human Parechovirus 1 2A protein 分子名称: ACETATE ION, Protein 2A, SODIUM ION 著者 von Castelmur, E, Perrakis, A. 登録日 2022-05-11 公開日 2023-05-24 最終更新日 2024-06-19 実験手法 X-RAY DIFFRACTION (1.93 Å) 主引用文献 Human Parechovirus 1 2A protein To Be Published
8TGC	Structure of Red beta C-terminal domain in complex with SSB C-terminal peptide, Form 4 分子名称: Plasmid-derived single-stranded DNA-binding protein, Recombination protein bet 著者 Bell, C.E. 登録日 2023-07-12 公開日 2024-03-13 最終更新日 2024-05-15 実験手法 X-RAY DIFFRACTION (1.484 Å) 主引用文献 Structural Basis for the Interaction of Red beta Single-Strand Annealing Protein with Escherichia coli Single-Stranded DNA-Binding Protein. J.Mol.Biol., 436, 2024
6GPJ	Crystal structure of human GDP-D-mannose 4,6-dehydratase in complex with GDP-4F-Man 分子名称: 1,2-ETHANEDIOL, CITRIC ACID, GDP-mannose 4,6 dehydratase, ... 著者 Pfeiffer, M, Krojer, T, Johansson, C, von Delft, F, Bountra, C, Arrowsmith, C.H, Edwards, A, Nidetzky, B, Oppermann, U, Structural Genomics Consortium (SGC) 登録日 2018-06-06 公開日 2018-07-18 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.94 Å) 主引用文献 A Parsimonious Mechanism of Sugar Dehydration by Human GDP-Mannose-4,6-dehydratase. Acs Catalysis, 9, 2019
6HMJ	Structure of an RNA-binding Light-Oxygen-Voltage Receptor 分子名称: 1,2-ETHANEDIOL, FLAVIN MONONUCLEOTIDE, GLYCEROL, ... 著者 Ziegler, T, Moniot, S, Moeglich, A. 登録日 2018-09-12 公開日 2019-08-28 最終更新日 2024-05-15 実験手法 X-RAY DIFFRACTION (2.51 Å) 主引用文献 A blue light receptor that mediates RNA binding and translational regulation. Nat.Chem.Biol., 15, 2019
7ZU4	Crystal Structure of Human Parechovirus 1 2A protein lacking the C-terminal oligomerisation helix 分子名称: 1,2-ETHANEDIOL, GLYCEROL, Protein 2A, ... 著者 von Castelmur, E, Perrakis, A. 登録日 2022-05-11 公開日 2023-05-24 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Human Parechovirus 1 2A protein To Be Published
6X8Z	Crystal structure of N-truncated human B12 chaperone CblD(C262S)-thiolato-cob(III)alamin complex (108-296) 分子名称: COBALAMIN, Methylmalonic aciduria and homocystinuria type D protein, mitochondrial 著者 Mascarenhas, R, Li, Z, Koutmos, M, Banerjee, R. 登録日 2020-06-02 公開日 2020-09-16 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 An Interprotein Co-S Coordination Complex in the B 12 -Trafficking Pathway. J.Am.Chem.Soc., 142, 2020
7ZV6	Crystal Structure of Aichivirus A 2A protein 分子名称: Protein 2A 著者 von Castelmur, E, Perrakis, A. 登録日 2022-05-13 公開日 2023-05-24 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (2.83 Å) 主引用文献 Structural and functional repurposing of picornavirus H/NC-motif 2A proteins To Be Published
6GQA	Cell division regulator S. pneumoniae GpsB 分子名称: Cell cycle protein GpsB 著者 Lewis, R.J, Rutter, Z.J. 登録日 2018-06-07 公開日 2019-01-23 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 The cell cycle regulator GpsB functions as cytosolic adaptor for multiple cell wall enzymes. Nat Commun, 10, 2019
6O4L	Structure of ALDH7A1 mutant E399D complexed with NAD 分子名称: 1,2-ETHANEDIOL, Alpha-aminoadipic semialdehyde dehydrogenase, CHLORIDE ION, ... 著者 Tanner, J.J, Korasick, D.A, Laciak, A.R. 登録日 2019-02-28 公開日 2019-11-06 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Structural analysis of pathogenic mutations targeting Glu427 of ALDH7A1, the hot spot residue of pyridoxine-dependent epilepsy. J. Inherit. Metab. Dis., 43, 2020
7T9R	Crystal structure of Crocodile defensin CpoBD13:phosphatidic acid complex 分子名称: (R)-2-(FORMYLOXY)-3-(PHOSPHONOOXY)PROPYL PENTANOATE, 1,2-ETHANEDIOL, CpoBD13, ... 著者 Kvansakul, M, Williams, S, Hulett, M.D. 登録日 2021-12-19 公開日 2023-01-18 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Crocodile defensin (CpoBD13) antifungal activity via pH-dependent phospholipid targeting and membrane disruption. Nat Commun, 14, 2023
6CPB	Crystal structure of the heme domain of CooA from Carboxydothermus hydrogenoformans 分子名称: Carbon monoxide oxidation system transcription regulator CooA-1, GLYCEROL, SULFATE ION 著者 Tripathi, S.M, Poulos, T.L. 登録日 2018-03-13 公開日 2018-05-16 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.155 Å) 主引用文献 Testing the N-Terminal Velcro Model of CooA Carbon Monoxide Activation. Biochemistry, 57, 2018
6GQI	Thermocrispum municipale cyclohexanone monooxygenase bound to hexanoic acid 分子名称: ACETATE ION, Cyclohexanone Monooxygenase from Thermocrispum municipale, FLAVIN-ADENINE DINUCLEOTIDE, ... 著者 Mattevi, A, Gomez Castellanos, J.R. 登録日 2018-06-07 公開日 2018-12-12 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Side-Chain Pruning Has Limited Impact on Substrate Preference in a Promiscuous Enzyme. ACS Catal, 8, 2018
6X9D	Structure of proline utilization A with trans-4-hydroxy-L-proline bound in the L-glutamate-gamma-semialdehyde dehydrogenase active site 分子名称: 4-HYDROXYPROLINE, Bifunctional protein PutA, DI(HYDROXYETHYL)ETHER, ... 著者 Tanner, J.J, Campbell, A.C. 登録日 2020-06-02 公開日 2020-12-30 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.54 Å) 主引用文献 Structural analysis of prolines and hydroxyprolines binding to the l-glutamate-gamma-semialdehyde dehydrogenase active site of bifunctional proline utilization A. Arch.Biochem.Biophys., 698, 2020
6GH3	Paenibacillus sp. YM1 laminaribiose phosphorylase with alpha-man-1-phosphate bound 分子名称: 1,2-ETHANEDIOL, 1-O-phosphono-alpha-D-mannopyranose, CHLORIDE ION, ... 著者 Kuhaudomlarp, S, Walpole, S, Stevenson, C.E.M, Nepogodiev, S.A, Lawson, D.M, Angulo, J, Field, R.A. 登録日 2018-05-04 公開日 2018-06-13 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.82 Å) 主引用文献 Unravelling the Specificity of Laminaribiose Phosphorylase from Paenibacillus sp. YM-1 towards Donor Substrates Glucose/Mannose 1-Phosphate by Using X-ray Crystallography and Saturation Transfer Difference NMR Spectroscopy. Chembiochem, 20, 2019
6HPA	Crystal structure of a BA3943 mutant,a CE4 family pseudoenzyme 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Putative polysaccharide deacetylase, SULFATE ION 著者 Molfetas, A, Tomatsidou, N, Kokkinidis, M. 登録日 2018-09-20 公開日 2019-10-09 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (1.554 Å) 主引用文献 The resurrection of a dean enzyme To Be Published
6CPN	Crystal structure of DR11 presenting the RQ13 peptide 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Gag polyprotein, ... 著者 Farenc, C, Gras, S, Rossjohn, J. 登録日 2018-03-13 公開日 2018-06-06 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 CD4+T cell-mediated HLA class II cross-restriction in HIV controllers. Sci Immunol, 3, 2018
6XLX	Crystal structure of cancer-associated G301D mutant of U2AF65 bound to AdML splice site 分子名称: DNA/RNA (5'-R(P*UP*UP*(UD)P*UP*U)-D(P*(BRU))-R(P*CP*C)-3'), Splicing factor U2AF 65 kDa subunit 著者 Maji, D, Jenkins, J.L, Kielkopf, C.L. 登録日 2020-06-29 公開日 2020-10-07 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Representative cancer-associated U2AF2 mutations alter RNA interactions and splicing. J.Biol.Chem., 295, 2020
6O5E	Crystal structure of the Vitronectin hemopexin-like domain 分子名称: CHLORIDE ION, IMIDAZOLE, NITRATE ION, ... 著者 Lechtenberg, B.C, Shin, K, Marassi, F.M. 登録日 2019-03-01 公開日 2019-09-18 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structure of human Vitronectin C-terminal domain and interaction withYersinia pestisouter membrane protein Ail. Sci Adv, 5, 2019

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