PDB: 30867 件ウェブページステータス検索Chemie searchBIRD

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8TBK	Tricomplex of RMC-7977, KRAS G12C, and CypA 分子名称: (1R,5S,6r)-N-[(1P,7S,9S,13S,20M)-20-{5-(4-cyclopropylpiperazin-1-yl)-2-[(1S)-1-methoxyethyl]pyridin-3-yl}-21-ethyl-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetraazapentacyclo[17.5.2.1~2,5~.1~9,13~.0~22,26~]octacosa-1(24),2,5(28),19,22,25-hexaen-7-yl]-3-oxabicyclo[3.1.0]hexane-6-carboxamide, GTPase KRas, MAGNESIUM ION, ... 著者 Tomlinson, A.C.A, Chen, A, Knox, J.E, Yano, J.K. 登録日 2023-06-28 公開日 2024-02-07 最終更新日 2024-06-05 実験手法 X-RAY DIFFRACTION (1.26 Å) 主引用文献 Concurrent inhibition of oncogenic and wild-type RAS-GTP for cancer therapy. Nature, 629, 2024
6DC4	RSV-neutralizing human antibody AM22 分子名称: 1,2-ETHANEDIOL, Fab AM22 Heavy Chain, Fab AM22 Light Chain 著者 Jones, H.G, McLellan, J.S. 登録日 2018-05-04 公開日 2019-07-10 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Alternative conformations of a major antigenic site on RSV F. Plos Pathog., 15, 2019
8BJH	chimera of the inactive ExoY Nucleotidyl Cyclase domain from Vibrio nigripulchritudo MARTX toxin, with the double mutation K3528M and K3535I, fused to a proline-Rich-Domain (PRD) and profilin, bound to Latrunculin B-ADP-Mg-actin 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, ADENOSINE-5'-DIPHOSPHATE, Actin, ... 著者 Teixeira-Nunes, M, Renault, L, Retailleau, P. 登録日 2022-11-04 公開日 2023-09-20 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.69 Å) 主引用文献 Functional and structural insights into the multi-step activation and catalytic mechanism of bacterial ExoY nucleotidyl cyclase toxins bound to actin-profilin. Plos Pathog., 19, 2023
6DR4	X-ray crystallographic structure of a covalent trimer derived from A-beta 17_36 containing the I31V point mutation 分子名称: HEXANE-1,6-DIOL, ORN-CYS-VAL-PHE-MEA-CYS-GLU-ASP-ORN-ALA-VAL-ILE-GLY-LEU-ORN-VAL 著者 Salveson, P.J, Nowick, J.S. 登録日 2018-06-11 公開日 2018-10-17 最終更新日 2020-01-01 実験手法 X-RAY DIFFRACTION (2.105 Å) 主引用文献 Repurposing Triphenylmethane Dyes to Bind to Trimers Derived from A beta. J. Am. Chem. Soc., 140, 2018
8BBQ	Determination of the structure of active tyrosinase from bacterium Verrucomicrobium spinosum 分子名称: COPPER (II) ION, Core tyrosinase, GLYCEROL, ... 著者 Fekry, M, Dave, K, Badgujar, D, Aurelius, O, Hamnevik, E, Dobritzsch, D, Danielson, H. 登録日 2022-10-14 公開日 2023-09-20 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.43 Å) 主引用文献 The Crystal Structure of Tyrosinase from Verrucomicrobium spinosum Reveals It to Be an Atypical Bacterial Tyrosinase. Biomolecules, 13, 2023
5FFJ	Structure of a nuclease-deletion mutant of the Type ISP restriction-modification enzyme LlaGI in complex with a DNA substrate mimic 分子名称: DNA (5'-D(P*TP*AP*GP*CP*TP*AP*AP*TP*AP*GP*AP*CP*TP*GP*GP*AP*TP*GP*GP*AP*GP*G)-3'), DNA (5'-D(P*TP*CP*CP*TP*CP*CP*AP*TP*CP*CP*AP*GP*TP*CP*TP*AP*TP*TP*AP*GP*CP*T)-3'), Endonuclease and methylase LlaGI 著者 Saikrishnan, K, Kulkarni, M, Nirwan, N. 登録日 2015-12-18 公開日 2016-03-30 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.84 Å) 主引用文献 Structural insights into DNA sequence recognition by Type ISP restriction-modification enzymes Nucleic Acids Res., 44, 2016
5FHC	Crystal Structure of Protective Human Antibodies 100 and 114 in Complex with Ebola Virus Fusion Glycoprotein (GP) 分子名称: Antibody 100 Fab heavy chain, Antibody 100 Fab light chain, Antibody 114 Fab heavy chain, ... 著者 Gilman, M.S.A, McLellan, J.S. 登録日 2015-12-21 公開日 2016-03-16 最終更新日 2016-03-30 実験手法 X-RAY DIFFRACTION (6.704 Å) 主引用文献 Structural and molecular basis for Ebola virus neutralization by protective human antibodies. Science, 351, 2016
6REG	Crystal structure of Pizza6-S with Zn2+ 分子名称: GLYCEROL, Pizza6-S, ZINC ION 著者 Noguchi, H, Clarke, D.E, Gryspeerdt, J.L, Feyter, S.D, Voet, A.R.D. 登録日 2019-04-12 公開日 2019-07-31 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.3 Å) 主引用文献 Artificial beta-propeller protein-based hydrolases. Chem.Commun.(Camb.), 55, 2019
8TBI	Tricomplex of RMC-7977, NRAS WT, and CypA 分子名称: (1R,5S,6r)-N-[(1P,7S,9S,13S,20M)-20-{5-(4-cyclopropylpiperazin-1-yl)-2-[(1S)-1-methoxyethyl]pyridin-3-yl}-21-ethyl-17,17-dimethyl-8,14-dioxo-15-oxa-4-thia-9,21,27,28-tetraazapentacyclo[17.5.2.1~2,5~.1~9,13~.0~22,26~]octacosa-1(24),2,5(28),19,22,25-hexaen-7-yl]-3-oxabicyclo[3.1.0]hexane-6-carboxamide, GTPase NRas, MAGNESIUM ION, ... 著者 Tomlinson, A.C.A, Chen, A, Knox, J.E, Yano, J.K. 登録日 2023-06-28 公開日 2024-02-07 最終更新日 2024-06-05 実験手法 X-RAY DIFFRACTION (1.59 Å) 主引用文献 Concurrent inhibition of oncogenic and wild-type RAS-GTP for cancer therapy. Nature, 629, 2024
6REK	Crystal structure of Pizza6-SH with Cu2+ 分子名称: COPPER (II) ION, GLYCEROL, Pizza6-SH 著者 Noguchi, H, Clarke, D.E, Gryspeerdt, J.L, Feyter, S.D, Voet, A.R.D. 登録日 2019-04-12 公開日 2019-07-31 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.1 Å) 主引用文献 Artificial beta-propeller protein-based hydrolases. Chem.Commun.(Camb.), 55, 2019
8SWE	FGFR2 Kinase Domain Bound to Reversible Inhibitor Cmpd 3 分子名称: Fibroblast growth factor receptor 2, GLUTATHIONE, GLYCEROL, ... 著者 Valverde, R, Foster, L. 登録日 2023-05-18 公開日 2024-02-14 実験手法 X-RAY DIFFRACTION (2.24 Å) 主引用文献 Discovery of lirafugratinib (RLY-4008), a highly selective irreversible small-molecule inhibitor of FGFR2. Proc.Natl.Acad.Sci.USA, 121, 2024
5FI3	HETEROYOHIMBINE SYNTHASE THAS1 FROM CATHARANTHUS ROSEUS - COMPLEX WITH NADP+ 分子名称: 1,2-ETHANEDIOL, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE, Tetrahydroalstonine synthase, ... 著者 Stavrinides, A, Tatsis, E.C, Caputi, L, Foureau, E, Stevenson, C.E.M, Lawson, D.M, Courdavault, V, O'Connor, S.E. 登録日 2015-12-22 公開日 2016-07-27 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (1.05 Å) 主引用文献 Structural investigation of heteroyohimbine alkaloid synthesis reveals active site elements that control stereoselectivity. Nat Commun, 7, 2016
8B39	Small molecular stabilizer for ERalpha and 14-3-3 (1080299) 分子名称: 14-3-3 protein sigma, 2-chloranyl-~{N}-[[1-[(2~{S},6~{R})-4-[(4-chlorophenyl)amino]-2,6-dimethyl-oxan-4-yl]carbonylpiperidin-4-yl]methyl]ethanamide, Estrogen receptor, ... 著者 Visser, E.J, Vandenboorn, E.M.F, Ottmann, C. 登録日 2022-09-16 公開日 2023-09-20 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Structure-Based Optimization of Covalent, Small-Molecule Stabilizers of the 14-3-3 sigma /ER alpha Protein-Protein Interaction from Nonselective Fragments. J.Am.Chem.Soc., 145, 2023
6GOO	Crystal Structure Of Sea Bream Transthyretin in complex with Perfluorooctanoic acid (PFOA). Crystallized in AmSO4 分子名称: Transthyretin, pentadecafluorooctanoic acid 著者 Grundstrom, C, Zhang, J, Olofsson, A, Andersson, P.L, Sauer-Eriksson, A.E. 登録日 2018-06-01 公開日 2018-07-11 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Interspecies Variation between Fish and Human Transthyretins in Their Binding of Thyroid-Disrupting Chemicals. Environ. Sci. Technol., 52, 2018
7REW	Crystal Structure of IL-13 in complex with MMAb3 Fab 分子名称: IL13, anti-cyno interleukin 13 Fab heavy chain, anti-cyno interleukin 13 Fab light chain 著者 Sudom, A, Min, X. 登録日 2021-07-13 公開日 2022-05-25 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Development of a potent high-affinity human therapeutic antibody via novel application of recombination signal sequence-based affinity maturation. J.Biol.Chem., 298, 2022
5WLH	Crystal structure of LbaCas13a H328A (C2c2) bound to pre-crRNA (24-nt spacer) 分子名称: GLYCEROL, IODIDE ION, LbaCas13a H328A (C2c2), ... 著者 Knott, G.J, Doudna, J.A. 登録日 2017-07-26 公開日 2017-09-13 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (1.80001032 Å) 主引用文献 Guide-bound structures of an RNA-targeting A-cleaving CRISPR-Cas13a enzyme. Nat. Struct. Mol. Biol., 24, 2017
6I7I	Crystal structure of dimeric FICD mutant K256A complexed with MgATP 分子名称: 3,6,9,12,15,18-HEXAOXAICOSANE-1,20-DIOL, ADENOSINE-5'-TRIPHOSPHATE, Adenosine monophosphate-protein transferase FICD, ... 著者 Perera, L.A, Yan, Y, Read, R.J, Ron, D. 登録日 2018-11-16 公開日 2019-09-25 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.33 Å) 主引用文献 An oligomeric state-dependent switch in the ER enzyme FICD regulates AMPylation and deAMPylation of BiP. Embo J., 38, 2019
6CAV	Aminoglycoside Phosphotransferase (2'')-Ia in complex with GMPPNP, Magnesium, and Dibekacin 分子名称: Bifunctional AAC/APH, CHLORIDE ION, Dibekacin, ... 著者 Caldwell, S.J, Berghuis, A.M. 登録日 2018-02-01 公開日 2018-04-11 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Plasticity of Aminoglycoside Binding to Antibiotic Kinase APH(2′′)-Ia. Antimicrob. Agents Chemother., 62, 2018
6GOA	Structural basis for OXA-48 dimerization - R189A mutant 分子名称: Beta-lactamase, CHLORIDE ION 著者 Lund, B.A, Thomassen, A.M, Leiros, H.K.S. 登録日 2018-06-01 公開日 2018-07-18 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (2.55 Å) 主引用文献 The biological assembly of OXA-48 reveals a dimer interface with high charge complementarity and very high affinity. FEBS J., 285, 2018
7LGN	Cyanophycin synthetase 1 from T. morbirosei 分子名称: Cyanophycin synthase 著者 Sharon, I, Schmeing, T.M. 登録日 2021-01-20 公開日 2021-08-18 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (3.1 Å) 主引用文献 Structures and function of the amino acid polymerase cyanophycin synthetase. Nat.Chem.Biol., 17, 2021
8BO1	ExoY Nucleotidyl Cyclase domain from Vibrio nigripulchritudo MARTX toxin, bound to Latrunculin-B-ATP-Mg-actin, and 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE and 2 Mg ions 分子名称: 3'-DEOXYADENOSINE-5'-TRIPHOSPHATE, ADENOSINE-5'-TRIPHOSPHATE, AZIDE ION, ... 著者 Teixeira-Nunes, M, Renault, L, Retailleau, P. 登録日 2022-11-14 公開日 2023-09-20 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (2.501 Å) 主引用文献 Functional and structural insights into the multi-step activation and catalytic mechanism of bacterial ExoY nucleotidyl cyclase toxins bound to actin-profilin. Plos Pathog., 19, 2023
5FGS	Crystal structure of C-terminal domain of shaft pilin spaA from Lactobacillus rhamnosus GG - P21212 space group 分子名称: Cell surface protein SpaA, ZINC ION 著者 Chaurasia, P, Pratap, S, von Ossowski, I, Palva, A, Krishnan, V. 登録日 2015-12-21 公開日 2016-07-20 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 New insights about pilus formation in gut-adapted Lactobacillus rhamnosus GG from the crystal structure of the SpaA backbone-pilin subunit Sci Rep, 6, 2016
6R9H	Crystal structure of the PDZ tandem of syntenin in complex with fragment C58 分子名称: (2~{S})-2-[2-(4-chlorophenyl)sulfanylethanoylamino]-3-methyl-butanoic acid, ACETATE ION, PHOSPHATE ION, ... 著者 Feracci, M, Barral, K. 登録日 2019-04-03 公開日 2021-02-03 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Pharmacological inhibition of syntenin PDZ2 domain impairs breast cancer cell activities and exosome loadifing with syndecan and EpCAM cargo. J Extracell Vesicles, 10, 2020
5FJ2	Structure of bovine endothelial nitric oxide synthase heme domain in complex with 7-((4-CHLORO-3-((METHYLAMINO)METHYL) PHENOXY)METHYL)QUINOLIN-2-AMINE 分子名称: 5,6,7,8-TETRAHYDROBIOPTERIN, 7-[[4-chloranyl-3-(methylaminomethyl)phenoxy]methyl]quinolin-2-amine, ACETATE ION, ... 著者 Li, H, Poulos, T.L. 登録日 2015-10-06 公開日 2015-10-28 最終更新日 2015-11-25 実験手法 X-RAY DIFFRACTION (2.05 Å) 主引用文献 Phenyl Ether- and Aniline-Containing 2-Aminoquinolines as Potent and Selective Inhibitors of Neuronal Nitric Oxide Synthase. J.Med.Chem., 58, 2015
6GPZ	Cell division regulator GpsB in complex with peptide fragment of L. monocytogenes Penicillin Binding Protein PBPA1 分子名称: Cell cycle protein GpsB, IMIDAZOLE, LmPBPA1, ... 著者 Cleverley, R.M, 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 (1.6 Å) 主引用文献 The cell cycle regulator GpsB functions as cytosolic adaptor for multiple cell wall enzymes. Nat Commun, 10, 2019

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