PDB: 243531 件ウェブページステータス検索Chemie searchBIRD

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6OVO	Crystal structure of the unliganded PG10 TCR 分子名称: 1,2-ETHANEDIOL, Alpha Chain T-Cell Receptor PG10, Beta Chain T-Cell Receptor PG10, ... 著者 Shahine, A, Rossjohn, J. 登録日 2019-05-08 公開日 2019-11-20 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (2.49 Å) 主引用文献 A TCR beta-Chain Motif Biases toward Recognition of Human CD1 Proteins. J Immunol., 203, 2019
8GBV	Crystal structure of PC39-17A, an anti-HIV broadly neutralizing antibody 分子名称: 1,2-ETHANEDIOL, ACETATE ION, PC39-17A Fab heavy chain, ... 著者 Murrell, S, Omorodion, O, Wilson, I.A. 登録日 2023-02-28 公開日 2023-06-07 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (2.08 Å) 主引用文献 Antigen pressure from two founder viruses induces multiple insertions at a single antibody position to generate broadly neutralizing HIV antibodies. Plos Pathog., 19, 2023
8GDS	CRYSTAL STRUCTURE OF RHO-ASSOCIATED PROTEIN KINASE 2 (ROCK2) IN COMPLEX WITH 4-(4-(2-(2,3-DIHYDRO-1H- INDOL-1-YL)-2-OXOETHYL)PHENYL)-1(2H)-PHTHALAZINONE 分子名称: 4-{4-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]phenyl}phthalazin-1(2H)-one, Rho-associated protein kinase 2, SULFATE ION 著者 Muckelbauer, J.K. 登録日 2023-03-06 公開日 2023-05-10 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (2.71 Å) 主引用文献 Phthalazinone-based lactams and cyclic ureas as ROCK2 selective inhibitors. Bioorg.Med.Chem.Lett., 88, 2023
6XLZ	Structure of NHP D11A.F2 Fab in complex with 16055 V2b peptide 分子名称: (R,R)-2,3-BUTANEDIOL, Envelope glycoprotein gp160, NHP_D11A.F2_Fab_Heavy_chain, ... 著者 Aljedani, S, Rodarte, J, Liban, T, Pancera, M. 登録日 2020-06-29 公開日 2021-07-07 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Structurally related but genetically unrelated antibody lineages converge on an immunodominant HIV-1 Env neutralizing determinant following trimer immunization. Plos Pathog., 17, 2021
6OCX	Structure of human CIB1 in complex with peptide inhibitor UNC10245109 分子名称: CALCIUM ION, Calcium and integrin-binding protein 1, Peptide inhibitor UNC10245109 著者 Puhl, A.C, Godoy, A.S, Pearce, K. 登録日 2019-03-25 公開日 2020-03-25 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Discovery and Characterization of Peptide Inhibitors for Calcium and Integrin Binding Protein 1. Acs Chem.Biol., 15, 2020
5N5S	Crystal structure of aldehyde dehydrogenase 21 (ALDH21) from Physcomitrella patens in complex with NADP+ 分子名称: 1,2-ETHANEDIOL, Aldehyde dehydrogenase 21 (ALDH21), NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE 著者 Kopecny, D, Vigouroux, A, Briozzo, P, Morera, S. 登録日 2017-02-14 公開日 2017-08-09 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 The ALDH21 gene found in lower plants and some vascular plants codes for a NADP(+) -dependent succinic semialdehyde dehydrogenase. Plant J., 92, 2017
6ZWF	Neisseria gonorrhoeae transaldolase 分子名称: 1,2-ETHANEDIOL, BETA-MERCAPTOETHANOL, CITRIC ACID, ... 著者 Rabe von Pappenheim, F, Wensien, M, Funk, L.-M, Sautner, V, Tittmann, K. 登録日 2020-07-28 公開日 2021-03-24 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.05 Å) 主引用文献 A lysine-cysteine redox switch with an NOS bridge regulates enzyme function. Nature, 593, 2021
6ZXB	Diguanylate cyclase DgcR (I-site mutant) in native state 分子名称: 1,2-ETHANEDIOL, 3'-DEOXY-GUANOSINE-5'-TRIPHOSPHATE, MAGNESIUM ION, ... 著者 Teixeira, R.D, Schirmer, T. 登録日 2020-07-29 公開日 2021-03-31 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Activation mechanism of a small prototypic Rec-GGDEF diguanylate cyclase. Nat Commun, 12, 2021
5LYG	CRYSTAL STRUCTURE OF INTRACELLULAR B30.2 DOMAIN OF BTN3A1 BOUND TO MALONATE 分子名称: 1,2-ETHANEDIOL, Butyrophilin subfamily 3 member A1, MALONATE ION 著者 Mohammed, F, Baker, A.T, Salim, M, Willcox, B.E. 登録日 2016-09-28 公開日 2017-09-13 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 BTN3A1 Discriminates gamma delta T Cell Phosphoantigens from Nonantigenic Small Molecules via a Conformational Sensor in Its B30.2 Domain. ACS Chem. Biol., 12, 2017
6OZK	Crystal structure of Mus musculus (Mm) Endonuclease V in complex with a 23mer RNA oligo containing an inosine after 68h soak in Ca2+ 分子名称: 1,2-ETHANEDIOL, CALCIUM ION, 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'), ... 著者 Samara, N.L, Yang, W. 登録日 2019-05-15 公開日 2019-09-04 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.104 Å) 主引用文献 Evolution of Inosine-Specific Endonuclease V from Bacterial DNase to Eukaryotic RNase. Mol.Cell, 76, 2019
8Q0T	Identification and optimisation of novel inhibitors of the Polyketide synthetase 13 thioesterase domain with antitubercular activity 分子名称: 3-(3,4-dimethoxyphenyl)-~{N}-[2-(3,4-dimethoxyphenyl)ethyl]-1,2,4-oxadiazole-5-carboxamide, Polyketide synthase Pks13 著者 Eadsforth, T.C, Punekar, A.S, Green, S.R, Baragana, B. 登録日 2023-07-29 公開日 2023-11-22 最終更新日 2023-12-06 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Identification and Optimization of Novel Inhibitors of the Polyketide Synthase 13 Thioesterase Domain with Antitubercular Activity. J.Med.Chem., 66, 2023
6ZXO	Crystal structure of His-tagged human thymidylate synthase (HT-hTS) in complex with FdUMP and Raltitrexed (Tomudex) 分子名称: 1,2-ETHANEDIOL, 5-FLUORO-2'-DEOXYURIDINE-5'-MONOPHOSPHATE, TOMUDEX, ... 著者 Pozzi, C, Mangani, S. 登録日 2020-07-30 公開日 2021-05-19 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Structural Bases for the Synergistic Inhibition of Human Thymidylate Synthase and Ovarian Cancer Cell Growth by Drug Combinations. Cancers (Basel), 13, 2021
8HAU	NARROW LEAF 1 from Indica 分子名称: ADENOSINE-5'-TRIPHOSPHATE, Protein NARROW LEAF 1 著者 Zhang, S.J, He, Y.J, Wang, N, Zhang, W.J, Liu, C.M. 登録日 2022-10-26 公開日 2024-06-05 実験手法 ELECTRON MICROSCOPY (3.02 Å) 主引用文献 NARROW LEAF 1 from Indica To Be Published
1MHH	Structure of P. magnus protein L mutant bound to a mouse Fab 分子名称: 1,2-ETHANEDIOL, Fab, heavy chain, ... 著者 Graille, M, Stura, E.A. 登録日 2002-08-20 公開日 2003-01-14 最終更新日 2025-03-26 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Evidence for plasticity and structural mimicry at the immunoglobulin light chain-protein L interface J.Biol.Chem., 277, 2002
8YU3	NMR solution structure of the 2:1 complex of a platinum(II) compound bound to Myc1234 G-quadruplex 分子名称: Bis(1,10-phenanthroline)platinum(II), DNA (5'-D(*TP*AP*GP*GP*GP*AP*GP*GP*GP*TP*AP*GP*GP*GP*AP*GP*GP*GP*T)-3') 著者 Liu, W, Mao, Z.W. 登録日 2024-03-26 公開日 2025-04-09 実験手法 SOLUTION NMR 主引用文献 Solution structures and effects of a platinum compound successively bound MYC G-quadruplex. Nucleic Acids Res., 52, 2024
1FDG	BINDING OF A MACROCYCLIC BISACRIDINE AND AMETANTRONE TO CGTACG INVOLVES SIMILAR UNUSUAL INTERCALATION PLATFORMS (AMETANTRONE COMPLEX) 分子名称: 1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)-ETHYLAMINO]-ANTHRAQUINONE, COBALT (II) ION, DNA (5'-D(*CP*GP*TP*AP*CP*G)-3'), ... 著者 Yang, X.-L, Robinson, H, Gao, Y.-G, Wang, A.H.-J. 登録日 2000-07-20 公開日 2000-08-07 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Binding of a macrocyclic bisacridine and ametantrone to CGTACG involves similar unusual intercalation platforms. Biochemistry, 39, 2000
1JTJ	Solution structure of HIV-1Lai mutated SL1 hairpin 分子名称: HIV-1Lai SL1 著者 Kieken, F, Arnoult, E, Barbault, F, Paquet, F, Huynh-Dinh, T, Paoletti, J, Genest, D, Lancelot, G. 登録日 2001-08-21 公開日 2002-12-11 最終更新日 2024-05-22 実験手法 SOLUTION NMR 主引用文献 HIV-1(Lai) genomic RNA: combined used of NMR and molecular dynamics simulation for studying the structure and internal dynamics of a mutated SL1 hairpin. EUR.BIOPHYS.J., 31, 2002
1D48	STRUCTURE OF THE PURE-SPERMINE FORM OF Z-DNA (MAGNESIUM FREE) AT 1 ANGSTROM RESOLUTION 分子名称: DNA (5'-D(*CP*GP*CP*GP*CP*G)-3'), SPERMINE 著者 Egli, M, Williams, L.D, Gao, Q, Rich, A. 登録日 1991-09-11 公開日 1992-04-15 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (1 Å) 主引用文献 Structure of the pure-spermine form of Z-DNA (magnesium free) at 1-A resolution. Biochemistry, 30, 1991
6W3A	Structure of unphosphorylated IRE1 in complex with G-7658 分子名称: Serine/threonine-protein kinase/endoribonuclease IRE1, ~{N}-[6-methyl-5-[3-[2-[[(3~{S})-piperidin-3-yl]amino]pyrimidin-4-yl]pyridin-2-yl]oxy-naphthalen-1-yl]but-2-ynamide 著者 Ferri, E, Wang, W, Joachim, R, Mortara, K. 登録日 2020-03-09 公開日 2020-12-09 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.606 Å) 主引用文献 Activation of the IRE1 RNase through remodeling of the kinase front pocket by ATP-competitive ligands. Nat Commun, 11, 2020
7MGL	Structure of human TRPML1 with ML-SI3 分子名称: 1,2-Distearoyl-sn-glycerophosphoethanolamine, Mucolipin-1, N-{(1S,2S)-2-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexyl}benzenesulfonamide 著者 Schmiege, P, Li, X. 登録日 2021-04-12 公開日 2021-06-16 最終更新日 2025-05-14 実験手法 ELECTRON MICROSCOPY (2.9 Å) 主引用文献 Atomic insights into ML-SI3 mediated human TRPML1 inhibition. Structure, 29, 2021
7MIE	Crystal structure of the Borreliella burgdorferi PlzA protein in complex with c-di-GMP 分子名称: 1,2-ETHANEDIOL, 9,9'-[(2R,3R,3aS,5S,7aR,9R,10R,10aS,12S,14aR)-3,5,10,12-tetrahydroxy-5,12-dioxidooctahydro-2H,7H-difuro[3,2-d:3',2'-j][1,3,7,9,2,8]tetraoxadiphosphacyclododecine-2,9-diyl]bis(2-amino-1,9-dihydro-6H-purin-6-one), CHLORIDE ION, ... 著者 Davies, C, Singh, A. 登録日 2021-04-16 公開日 2021-06-30 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 High-resolution crystal structure of the Borreliella burgdorferi PlzA protein in complex with c-di-GMP: new insights into the interaction of c-di-GMP with the novel xPilZ domain. Pathog Dis, 79, 2021
8Z77	The structure of thiocyanate dehydrogenase from Pelomicrobium methylotrophicum (pmTcDH), activated by crystals soaking with 1 mM CuCl2 and Na ascorbate during 12 hours 分子名称: 1,2-ETHANEDIOL, COPPER (II) ION, Twin-arginine translocation signal domain-containing protein 著者 Varfolomeeva, L.A, Solovieva, A.Y, Shipkov, N.S, Dergousova, N.I, Minyaev, M.E, Boyko, K.M, Tikhonova, T.V, Popov, V.O. 登録日 2024-04-19 公開日 2024-05-08 最終更新日 2025-05-21 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Effect of Copper Ions on the Crystal Packing and Conformation of Thiocyanate Dehydrogenase in the Crystal Structure Crystallography Reports, 70, 2025
6W61	Crystal Structure of the methyltransferase-stimulatory factor complex of NSP16 and NSP10 from SARS CoV-2. 分子名称: 1,2-ETHANEDIOL, 2'-O-methyltransferase, CHLORIDE ION, ... 著者 Kim, Y, Jedrzejczak, R, Maltseva, N, Endres, M, Godzik, A, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID) 登録日 2020-03-15 公開日 2020-03-25 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 The crystal structure of nsp10-nsp16 heterodimer from SARS-CoV-2 in complex with S-adenosylmethionine Biorxiv, 2020
8Z76	The structure of thiocyanate dehydrogenase from Pelomicrobium methylotrophicum (pmTcDH), activated by crystals soaking with 1 mM CuCl2 during 6 months 分子名称: 1,2-ETHANEDIOL, COPPER (II) ION, SODIUM ION, ... 著者 Varfolomeeva, L.A, Solovieva, A.Y, Shipkov, N.S, Dergousova, N.I, Boyko, K.M, Tikhonova, T.V, Popov, V.O. 登録日 2024-04-19 公開日 2024-05-08 最終更新日 2025-05-21 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Effect of Copper Ions on the Crystal Packing and Conformation of Thiocyanate Dehydrogenase in the Crystal Structure Crystallography Reports, 70, 2025
6W9I	SUBSTITUTED BENZYLOXYTRICYCLIC COMPOUNDS AS RETINOIC ACID-RELATED ORPHAN RECEPTOR GAMMA T AGONISTS 分子名称: 1-(benzyloxy)-4-{1-[(4-fluorophenyl)sulfonyl]cyclopentyl}benzene, Nuclear receptor ROR-gamma, Steroid receptor coactivator 1 fusion 著者 Sack, J.S. 登録日 2020-03-23 公開日 2020-04-29 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.608 Å) 主引用文献 Substituted benzyloxytricyclic compounds as retinoic acid-related orphan receptor gamma t (ROR gamma t) agonists. Bioorg.Med.Chem.Lett., 30, 2020

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