PDB: 31120 件ウェブページステータス検索Chemie searchBIRD

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7CWK	Structure of a triple-helix region of human collagen type I 分子名称: Collagen type I 著者 Zhu, Y, Yang, X, Sun, F. 登録日 2020-08-29 公開日 2021-09-01 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.539 Å) 主引用文献 Conformation in a triple-helix region of human collagen type I To Be Published
6OJW	Crystal structure of Sphingomonas paucimobilis TMY1009 holo-LsdA 分子名称: FE (III) ION, GLYCEROL, Lignostilbene-alpha,beta-dioxygenase isozyme I, ... 著者 Kuatsjah, E, Verstraete, M.M, Kobylarz, M.J, Liu, A.K.N, Murphy, M.E.P, Eltis, L.D. 登録日 2019-04-12 公開日 2019-07-24 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Identification of functionally important residues and structural features in a bacterial lignostilbene dioxygenase. J.Biol.Chem., 294, 2019
7DHL	Crystal structure of FGFR3 in complex with pyrimidine derivative 分子名称: 5-[2-(3,5-dimethoxyphenyl)ethyl]-N-[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrimidin-2-amine, Fibroblast growth factor receptor 3 著者 Echizen, Y, Tateishi, Y, Amano, Y. 登録日 2020-11-16 公開日 2021-02-03 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (2.57 Å) 主引用文献 Synthesis and structure-activity relationships of pyrimidine derivatives as potent and orally active FGFR3 inhibitors with both increased systemic exposure and enhanced in vitro potency. Bioorg.Med.Chem., 33, 2021
7D7U	Crystal structure of Ago2 MID domain in complex with 8-Br-adenosin-5'-monophosphate 分子名称: 8-BROMO-ADENOSINE-5'-MONOPHOSPHATE, Protein argonaute-2 著者 Suzuki, M, Takahashi, Y, Saito, J, Miyagi, H, Shinohara, F. 登録日 2020-10-06 公開日 2020-11-25 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 siRNA potency enhancement via chemical modifications of nucleotide bases at the 5'-end of the siRNA guide strand. Rna, 27, 2021
6O9S	Crystal structure of Staphylococcus aureus MecR1 antibiotic-sensor domain in complex with avibactam 分子名称: (2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide, Methicillin resistance mecR1 protein, SULFATE ION 著者 Alexander, J.A.N, Strynadka, N.C.J. 登録日 2019-03-14 公開日 2020-06-10 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.59 Å) 主引用文献 Structural analysis of avibactam-mediated activation of the bla and mec divergons in methicillin-resistant Staphylococcus aureus . J.Biol.Chem., 295, 2020
6O9W	Crystal structure of Staphylococcus aureus BlaR1 antibiotic-sensor domain in complex with avibactam 分子名称: (2S,5R)-1-formyl-5-[(sulfooxy)amino]piperidine-2-carboxamide, Regulatory protein BlaR1 著者 Alexander, J.A.N, Strynadka, N.C.J. 登録日 2019-03-15 公開日 2020-06-10 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Structural analysis of avibactam-mediated activation of the bla and mec divergons in methicillin-resistant Staphylococcus aureus . J.Biol.Chem., 295, 2020
6OH7	Crystal structure of (E)-biformene synthase LrdC from Streptomyces sp. strain K155 in complex with Mg 分子名称: DI(HYDROXYETHYL)ETHER, GLYCEROL, Labdane-related diterpene synthase, ... 著者 Centeno-Leija, S, Serrano-Posada, H. 登録日 2019-04-04 公開日 2019-04-17 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.19 Å) 主引用文献 The structure of (E)-biformene synthase provides insights into the biosynthesis of bacterial bicyclic labdane-related diterpenoids. J.Struct.Biol., 207, 2019
6OOW	The crystal structure of 4-ethylbenzoate bound to T252A mutant of CYP199A4 分子名称: 4-ethylbenzoic acid, CHLORIDE ION, Cytochrome P450, ... 著者 Coleman, T, Bruning, J.B, Bell, S.G. 登録日 2019-04-23 公開日 2020-04-29 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Structural investigation of the interplay between the substrate and the acid-alcohol pair of residues in cytochrome P450 enzymes To Be Published
6OQI	CDK2 in complex with Cpd14 (5-fluoro-4-(4-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepin-3-yl)-N-(5-(4-methylpiperazin-1-yl)pyridin-2-yl)pyrimidin-2-amine) 分子名称: 5-fluoro-N-[5-(4-methylpiperazin-1-yl)pyridin-2-yl]-4-[(4S)-4-methyl-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a]azepin-3-yl]pyrimidin-2-amine, Cyclin-dependent kinase 2 著者 Murray, J.M. 登録日 2019-04-26 公開日 2020-07-29 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Design of a brain-penetrant CDK4/6 inhibitor for glioblastoma. Bioorg.Med.Chem.Lett., 29, 2019
6O9B	Crystal structure of HLA-A3*01 in complex with a wild-type beta-catenin peptide 分子名称: 1,2-ETHANEDIOL, 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, Beta-2-microglobulin, ... 著者 Miller, M.S, Gabelli, S.B. 登録日 2019-03-13 公開日 2019-11-13 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 An engineered antibody fragment targeting mutant beta-catenin via major histocompatibility complex I neoantigen presentation. J.Biol.Chem., 294, 2019
6OS5	Crystal structure of CymD prenyltransferase complexed with L-tryptophan 分子名称: BENZOIC ACID, CymD prenyltransferase, DIPHOSPHATE, ... 著者 Roose, B.W, Christianson, D.W. 登録日 2019-05-01 公開日 2019-07-17 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.66 Å) 主引用文献 Structural Basis of Tryptophan Reverse N-Prenylation Catalyzed by CymD. Biochemistry, 58, 2019
6OHE	Alpha-L-fucosidase AlfC D200A in complex with Fuca(1,6)GlcNAc 分子名称: AlfC, alpha-L-fucopyranose-(1-6)-2-acetamido-2-deoxy-beta-D-glucopyranose 著者 Klontz, E.H, Sundberg, E.J. 登録日 2019-04-05 公開日 2020-04-08 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (3.14 Å) 主引用文献 Structure and dynamics of an alpha-fucosidase reveal a mechanism for highly efficient IgG transfucosylation. Nat Commun, 11, 2020
6OQ1	Crystal Structure of Branched K11/K48-Linked Tri-Ubiquitin 分子名称: Ubiquitin 著者 Boughton, A.J, Fushman, D. 登録日 2019-04-25 公開日 2019-10-23 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Branching via K11 and K48 Bestows Ubiquitin Chains with a Unique Interdomain Interface and Enhanced Affinity for Proteasomal Subunit Rpn1. Structure, 28, 2020
6OH8	Crystal structure of (E)-biformene synthase LrdC from Streptomyces sp. strain K155 in the dimeric form 分子名称: DI(HYDROXYETHYL)ETHER, GLYCEROL, Labdane-related diterpene synthase 著者 Centeno-Leija, S, Serrano-Posada, H. 登録日 2019-04-04 公開日 2019-04-17 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.17 Å) 主引用文献 The structure of (E)-biformene synthase provides insights into the biosynthesis of bacterial bicyclic labdane-related diterpenoids. J.Struct.Biol., 207, 2019
6OJR	Crystal structure of Sphingomonas paucimobilis TMY1009 apo-LsdA 分子名称: GLYCEROL, Lignostilbene-alpha,beta-dioxygenase isozyme I, MAGNESIUM ION 著者 Kuatsjah, E, Verstraete, M.M, Kobylarz, M.J, Liu, A.K.N, Murphy, M.E.P, Eltis, L.D. 登録日 2019-04-12 公開日 2019-07-24 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Identification of functionally important residues and structural features in a bacterial lignostilbene dioxygenase. J.Biol.Chem., 294, 2019
6OLT	Crosslinked Crystal Structure of Type II Fatty Acid Synthase Ketosynthase, FabF, and C12-crypto Acyl Carrier Protein, AcpP 分子名称: 3-oxoacyl-[acyl-carrier-protein] synthase 2, Acyl carrier protein, N-[2-(dodecanoylamino)ethyl]-N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alaninamide 著者 Mindrebo, J.T, Kim, W.E, Bartholow, T.G, Chen, A, Davis, T.D, La Clair, J, Burkart, M.D, Noel, J.P. 登録日 2019-04-17 公開日 2020-04-22 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.35 Å) 主引用文献 Gating mechanism of elongating beta-ketoacyl-ACP synthases. Nat Commun, 11, 2020
6OOX	The crystal structure of 4-isopropylbenzoate bound to T252A mutant of CYP199A4 分子名称: 4-propan-2-ylbenzoic acid, CHLORIDE ION, Cytochrome P450, ... 著者 Coleman, T, Bruning, J.B, Bell, S.G. 登録日 2019-04-23 公開日 2020-04-29 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.774 Å) 主引用文献 Structural investigation of the interplay between the substrate and the acid-alcohol pair of residues in cytochrome P450 enzymes To Be Published
6N3E	Structure of HIV Tat-specific factor 1 U2AF Homology Motif bound to U2AF ligand motif 4 分子名称: FORMIC ACID, GLYCEROL, HIV Tat-specific factor 1, ... 著者 Loerch, S, Jenkins, J.L, Kielkopf, C.L. 登録日 2018-11-15 公開日 2019-01-02 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (1.893 Å) 主引用文献 The pre-mRNA splicing and transcription factor Tat-SF1 is a functional partner of the spliceosome SF3b1 subunit via a U2AF homology motif interface. J. Biol. Chem., 294, 2019
6N3R	Sheep Galectin-11 (LGALS11) complex with galactose 分子名称: Galectin, beta-D-galactopyranose 著者 Beddoe, T.C, Sakthivel, D. 登録日 2018-11-16 公開日 2020-05-20 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.397 Å) 主引用文献 Sheep Galectin-11 (LGALS11) complex with galactose To be Published
7DC5	Crystal structure of fungal antifreeze protein with intermediate activity 分子名称: Antifreeze protein, SULFATE ION 著者 Khan, N.M.M.U, Arai, T, Tsuda, S, Kondo, H. 登録日 2020-10-23 公開日 2021-10-27 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.54 Å) 主引用文献 Characterization of microbial antifreeze protein with intermediate activity suggests that a bound-water network is essential for hyperactivity. Sci Rep, 11, 2021
7DDB	Crystal structure of fungal antifreeze protein with intermediate activity 分子名称: Antifreeze protein, MAGNESIUM ION 著者 Khan, N.M.M.U, Arai, T, Tsuda, S, Kondo, H. 登録日 2020-10-28 公開日 2021-11-03 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.72 Å) 主引用文献 Characterization of microbial antifreeze protein with intermediate activity suggests that a bound-water network is essential for hyperactivity. Sci Rep, 11, 2021
6OKC	Crosslinked Crystal Structure of Type II Fatty Acid Synthase Ketosynthase, FabB, and C12-crypto Acyl Carrier Protein, AcpP 分子名称: 3-oxoacyl-[acyl-carrier-protein] synthase 1, Acyl carrier protein, N-[2-(dodecanoylamino)ethyl]-N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alaninamide 著者 Mindrebo, J.T, Kim, W.E, Bartholow, T.G, Chen, A, Davis, T.D, La Clair, J, Burkart, M.D, Noel, J.P. 登録日 2019-04-12 公開日 2020-04-15 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 Gating mechanism of elongating beta-ketoacyl-ACP synthases. Nat Commun, 11, 2020
6OKG	Crosslinked Crystal Structure of Type II Fatty Acid Synthase Ketosynthase, FabF, and C16-crypto Acyl Carrier Protein, AcpP 分子名称: 3-oxoacyl-[acyl-carrier-protein] synthase 2, Acyl carrier protein, N-[2-(hexadecanoylamino)ethyl]-N~3~-[(2R)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alaninamide, ... 著者 Mindrebo, J.T, Kim, W.E, Bartholow, T.G, Chen, A, Davis, T.D, La Clair, J, Burkart, M.D, Noel, J.P. 登録日 2019-04-12 公開日 2020-04-22 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Gating mechanism of elongating beta-ketoacyl-ACP synthases. Nat Commun, 11, 2020
6O56	HNH Nuclease from S. pyogenes Cas9 分子名称: CRISPR-associated endonuclease Cas9/Csn1 著者 Newton, J.C, Lisi, G.P, Jogl, G. 登録日 2019-03-01 公開日 2020-01-15 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Allosteric Motions of the CRISPR-Cas9 HNH Nuclease Probed by NMR and Molecular Dynamics. J.Am.Chem.Soc., 142, 2020
6NRI	Crystal Structure of human PARP-1 ART domain bound to inhibitor UTT83 分子名称: (2Z)-2-{[4-(3-cyclopropyl-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carbonyl)phenyl]methylidene}-3-oxo-2,3-dihydro-1-benzofuran-7-carboxamide, CHLORIDE ION, CITRIC ACID, ... 著者 Langelier, M.F, Pascal, J.M. 登録日 2019-01-23 公開日 2019-08-14 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Design and Synthesis of Poly(ADP-ribose) Polymerase Inhibitors: Impact of Adenosine Pocket-Binding Motif Appendage to the 3-Oxo-2,3-dihydrobenzofuran-7-carboxamide on Potency and Selectivity. J.Med.Chem., 62, 2019

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