PDB: 224004 件ウェブページステータス検索Chemie searchBIRD

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7NA0	Structure of Geobacter sulfurreducens proline utilization A (PutA) variant A206W 分子名称: 1,2-ETHANEDIOL, Bifunctional protein PutA, FLAVIN-ADENINE DINUCLEOTIDE, ... 著者 Tanner, J.J, Korasick, D.A. 登録日 2021-06-19 公開日 2021-09-22 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Probing the function of a ligand-modulated dynamic tunnel in bifunctional proline utilization A (PutA). Arch.Biochem.Biophys., 712, 2021
4TVV	Crystal structure of LppA from Legionella pneumophila 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, CHLORIDE ION, GLYCEROL, ... 著者 Weber, S, Stirnimann, C, Wieser, M, Meier, R, Engelhardt, S, Li, X, Capitani, G, Kammerer, R, Hilbi, H. 登録日 2014-06-28 公開日 2014-11-05 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 A Type IV Translocated Legionella Cysteine Phytase Counteracts Intracellular Growth Restriction by Phytate. J.Biol.Chem., 289, 2014
7MYG	M. tb Ag85C modified by THL-10d 分子名称: Diacylglycerol acyltransferase, GLYCEROL 著者 Sudasinghe, T.D, Ronning, D.R. 登録日 2021-05-21 公開日 2021-09-15 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.51 Å) 主引用文献 Total Synthesis of Tetrahydrolipstatin, Its Derivatives, and Evaluation of Their Ability to Potentiate Multiple Antibiotic Classes against Mycobacterium Species. Acs Infect Dis., 7, 2021
7NMH	14-3-3 sigma with RelA/p65 binding site pS45 and covalently bound TCF521-070 分子名称: (5-methanoyl-2-nitro-phenyl) methanesulfonate, 14-3-3 protein sigma, CALCIUM ION, ... 著者 Wolter, M, Ottmann, C. 登録日 2021-02-23 公開日 2021-09-15 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 An Exploration of Chemical Properties Required for Cooperative Stabilization of the 14-3-3 Interaction with NF-kappa B-Utilizing a Reversible Covalent Tethering Approach. J.Med.Chem., 64, 2021
4TYL	Fragment-Based Screening of the Bromodomain of ATAD2 分子名称: 5-amino-1,3,6-trimethyl-1,3-dihydro-2H-benzimidazol-2-one, ATPase family AAA domain-containing protein 2, CHLORIDE ION, ... 著者 Harner, M.J, Chauder, B.A, Phan, J, Fesik, S.W. 登録日 2014-07-08 公開日 2014-10-29 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Fragment-Based Screening of the Bromodomain of ATAD2. J.Med.Chem., 57, 2014
4TYP	Crystal structure of an adenylate kinase mutant--AKm1 分子名称: Adenylate kinase, BIS(ADENOSINE)-5'-PENTAPHOSPHATE, ZINC ION 著者 Moon, S, Bae, E. 登録日 2014-07-09 公開日 2014-11-26 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.9 Å) 主引用文献 Crystal structures of thermally stable adenylate kinase mutants designed by local structural entropy optimization and structure-guided mutagenesis J KOREAN SOC APPL BIOL CHEM, 57, 2014
4U67	Crystal structure of the large ribosomal subunit (50S) of Deinococcus radiodurans containing a three residue insertion in L22 分子名称: 23s RNA, 50S ribosomal protein L13, 50S ribosomal protein L14, ... 著者 Wekselman, I, Zimmerman, E, Rozenberg, H, Bashan, A, Yonath, A. 登録日 2014-07-28 公開日 2015-08-05 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (3.65 Å) 主引用文献 The Ribosomal Protein uL22 Modulates the Shape of the Protein Exit Tunnel. Structure, 25, 2017
4U9Y	Structure of the alpha-tubulin acetyltransferase alpha-TAT1/Mec-17 in complex with CoA 分子名称: Alpha-tubulin N-acetyltransferase 1, BROMIDE ION, COENZYME A 著者 Yuzawa, S, Sumimoto, H. 登録日 2014-08-07 公開日 2015-08-12 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.201 Å) 主引用文献 Structure of the alpha-tubulin acetyltransferase alpha-TAT1/Mec-17 in complex with CoA To Be Published
4TZN	Structure of HTP-2 bound to HTP-3 motif-6 分子名称: Protein HTP-2, Protein HTP-3 著者 Rosenberg, S.C, Corbett, K.D. 登録日 2014-07-10 公開日 2014-11-19 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (3.115 Å) 主引用文献 The Chromosome Axis Controls Meiotic Events through a Hierarchical Assembly of HORMA Domain Proteins. Dev.Cell, 31, 2014
4UA6	CTX-M-14 Class A Beta-Lactamase Apo Crystal Structure at 0.79 Angstrom Resolution 分子名称: Beta-lactamase CTX-M-14, PHOSPHATE ION, POTASSIUM ION 著者 Nichols, D.A, Chen, Y. 登録日 2014-08-08 公開日 2015-06-24 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (0.79 Å) 主引用文献 Ligand-Induced Proton Transfer and Low-Barrier Hydrogen Bond Revealed by X-ray Crystallography. J.Am.Chem.Soc., 137, 2015
7MYB	Structure of proline utilization A with tetrahydrothiophene-2-carboxylate bound in the proline dehydrogenase active site 分子名称: (2R)-thiolane-2-carboxylic acid, (2S)-thiolane-2-carboxylic acid, Bifunctional protein PutA, ... 著者 Tanner, J.J, Campbell, A.C. 登録日 2021-05-20 公開日 2021-09-29 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.52 Å) 主引用文献 Photoinduced Covalent Irreversible Inactivation of Proline Dehydrogenase by S-Heterocycles. Acs Chem.Biol., 16, 2021
7N3J	E. coli peptidyl-prolyl cis-trans isomerase, mutant Phe27CF3-Tyr/Phe98CF3-Tyr 分子名称: Peptidyl-prolyl cis-trans isomerase B 著者 Frkic, R.L, Otting, G, Jackson, C.J. 登録日 2021-06-01 公開日 2021-09-29 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Through-Space Scalar 19 F- 19 F Couplings between Fluorinated Noncanonical Amino Acids for the Detection of Specific Contacts in Proteins. J.Am.Chem.Soc., 143, 2021
7MY9	Structure of proline utilization A with 1,3-dithiolane-2-carboxylate bound in the proline dehydrogenase active site 分子名称: 1,3-dithiolane-2-carboxylic acid, Bifunctional protein PutA, DI(HYDROXYETHYL)ETHER, ... 著者 Tanner, J.J, Campbell, A.C. 登録日 2021-05-20 公開日 2021-09-29 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.628 Å) 主引用文献 Photoinduced Covalent Irreversible Inactivation of Proline Dehydrogenase by S-Heterocycles. Acs Chem.Biol., 16, 2021
4U01	HCV NS3/4A serine protease in complex with 6570 分子名称: (2S,3aS,10Z,11aS,12aR)-2-({8-fluoro-7-methoxy-2-[4-(propan-2-yl)-1,3-thiazol-2-yl]quinolin-4-yl}oxy)-5-methyl-N-[(1-methylcyclopropyl)sulfonyl]-4,14-dioxo-1,2,3,3a,4,5,6,7,8,9,11a,12,13,14-tetradecahydro-12aH-cyclopropa[m]pyrrolo[1,2-c][1,3,6]triazacyclotetradecine-12a-carboxamide, CHLORIDE ION, NS4A protein, ... 著者 Parsy, C.C, Alexandre, F.-R, Brandt, G, Caillet, C, Chaves, D, Derock, M, Gloux, D, Griffon, Y, Lallos, L.B, Leroy, F, Liuzzi, M, Loi, A.-G, Mayes, B, Moulat, L, Moussa, A, Chiara, M, Roques, V, Rosinovsky, E, Seifer, M, Stewart, A, Wang, J, Standring, D, Surleraux, D. 登録日 2014-07-11 公開日 2015-07-29 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Discovery and structural diversity of the hepatitis C virus NS3/4A serine protease inhibitor series leading to clinical candidate IDX320. Bioorg.Med.Chem.Lett., 25, 2015
4U0Q	Plasmodium falciparum reticulocyte-binding protein homologue 5 (PfRH5) bound to basigin 分子名称: Basigin, Reticulocyte binding protein 5 著者 Wright, K.E, Hjerrild, K.A, Bartlett, J, Douglas, A.D, Jin, J, Brown, R.E, Ashfield, R, Clemmensen, S.B, de Jongh, W.A, Draper, S.J, Higgins, M.K. 登録日 2014-07-14 公開日 2014-08-13 最終更新日 2023-12-20 実験手法 X-RAY DIFFRACTION (3.1 Å) 主引用文献 Structure of malaria invasion protein RH5 with erythrocyte basigin and blocking antibodies. Nature, 515, 2014
7MYA	Structure of proline utilization A with the FAD covalently-modified by 1,3-dithiolane 分子名称: Bifunctional protein PutA, DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, ... 著者 Tanner, J.J, Campbell, A.C. 登録日 2021-05-20 公開日 2021-09-29 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.56 Å) 主引用文献 Photoinduced Covalent Irreversible Inactivation of Proline Dehydrogenase by S-Heterocycles. Acs Chem.Biol., 16, 2021
7MYC	Structure of proline utilization A with the FAD covalently modified by tetrahydrothiophene 分子名称: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE, Bifunctional protein PutA, DI(HYDROXYETHYL)ETHER, ... 著者 Tanner, J.J, Campbell, A.C. 登録日 2021-05-20 公開日 2021-09-29 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Photoinduced Covalent Irreversible Inactivation of Proline Dehydrogenase by S-Heterocycles. Acs Chem.Biol., 16, 2021
4U1B	HsMetAP in complex with (1-amino-2-propylpentyl)phosphonic acid 分子名称: COBALT (II) ION, GLYCEROL, Methionine aminopeptidase 1, ... 著者 Arya, T, Addlagatta, A. 登録日 2014-07-15 公開日 2015-03-25 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (1.89 Å) 主引用文献 Identification of the Molecular Basis of Inhibitor Selectivity between the Human and Streptococcal Type I Methionine Aminopeptidases J.Med.Chem., 58, 2015
1A1I	RADR (ZIF268 VARIANT) ZINC FINGER-DNA COMPLEX (GCAC SITE) 分子名称: DNA (5'-D(*AP*GP*CP*GP*TP*GP*GP*GP*CP*AP*C)-3'), DNA (5'-D(*TP*GP*TP*GP*CP*CP*CP*AP*CP*GP*C)-3'), RADR ZIF268 ZINC FINGER PEPTIDE, ... 著者 Elrod-Erickson, M, Benson, T.E, Pabo, C.O. 登録日 1997-12-10 公開日 1998-06-17 最終更新日 2023-08-02 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 High-resolution structures of variant Zif268-DNA complexes: implications for understanding zinc finger-DNA recognition. Structure, 6, 1998
4UCU	Fragment bound to H.influenza NAD dependent DNA ligase 分子名称: 1-(2,4-dimethylbenzyl)-6-oxo-1,6-dihydropyridine-3-carboxamide, 8-hydroxyquinoline-2-carboxylic acid, DNA LIGASE 著者 Hale, M, Brassington, C, Carcanague, D, Embrey, K, Eyermann, C.J, Giacobbe, R.A, Gingipali, L, Gowravaram, M, Harang, J, Howard, T, Ioannidis, G, Jahic, H, Kutschke, A, Laganas, V.A, Loch, J, Miller, M.D, Murphy-Benenato, K.E, Oguto, H, Otterbein, L, Patel, S.J, Shapiro, A.B, Boriack-Sjodin, P.A. 登録日 2014-12-04 公開日 2015-10-14 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 From Fragments to Leads: Novel Bacterial Nad+-Dependent DNA Ligase Inhibitors Tetrahedron Lett., 56, 2015
4UFU	Crystal structure of human tankyrase 2 in complex with TA-12 分子名称: 8-methyl-2-[4-(trifluoromethyl)phenyl]-3H-quinazolin-4-one, GLYCEROL, SULFATE ION, ... 著者 Haikarainen, T, Lehtio, L. 登録日 2015-03-19 公開日 2016-04-13 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Structure-Activity Relationships of 2-Arylquinazolin-4-Ones as Highly Selective and Potent Inhibitors of the Tankyrases. Eur.J.Med.Chem., 118, 2016
7N66	BACE-1 in complex with ligand 12 分子名称: Beta-secretase 1, DIMETHYL SULFOXIDE, GLYCEROL, ... 著者 Shaffer, P.L. 登録日 2021-06-07 公開日 2021-10-06 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 JNJ-67569762, A 2-Aminotetrahydropyridine-Based Selective BACE1 Inhibitor Targeting the S3 Pocket: From Discovery to Clinical Candidate. J.Med.Chem., 64, 2021
4U3A	Crystal structure of CtCel5E 分子名称: Endoglucanase H 著者 Yuan, S.F, Liang, P.H, Ho, M.C. 登録日 2014-07-19 公開日 2015-01-14 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.42 Å) 主引用文献 Biochemical Characterization and Structural Analysis of a Bifunctional Cellulase/Xylanase from Clostridium thermocellum J.Biol.Chem., 290, 2015
7NLG	S. cerevisiae Ty1 p22 restriction factor, Gag CA-CTD, AUG2 variant A273V mutant 分子名称: Ty1 Gag p22 著者 Cottee, M.A, Taylor, I.A. 登録日 2021-02-22 公開日 2021-10-06 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (3.528 Å) 主引用文献 Structure of a Ty1 restriction factor reveals the molecular basis of transposition copy number control. Nat Commun, 12, 2021
7NBW	Crystal structure of PqsR (MvfR) ligand-binding domain in complex with a pyridin agonist 分子名称: Transcriptional regulator MvfR, ~{N}-[3-(4-fluorophenyl)prop-2-ynyl]-2-(trifluoromethyl)pyridin-4-amine 著者 Schmelz, S, Blankenfeldt, W. 登録日 2021-01-28 公開日 2021-10-06 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (2.28 Å) 主引用文献 Divergent synthesis and biological evaluation of 2-(trifluoromethyl)pyridines as virulence-attenuating inverse agonists targeting PqsR. Eur.J.Med.Chem., 226, 2021

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