PDB: 36840 件ウェブページステータス検索Chemie searchBIRD

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6SVI	Non-terahertz irradiated structure of bovine trypsin (even frames of crystal x42) 分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... 著者 Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G. 登録日 2019-09-18 公開日 2020-01-22 最終更新日 2020-01-29 実験手法 X-RAY DIFFRACTION (1.16 Å) 主引用文献 Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties. Sci Rep, 9, 2019
6SVX	Reference structure of bovine trypsin (odd frames of crystal x33) 分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... 著者 Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G. 登録日 2019-09-19 公開日 2020-01-22 最終更新日 2020-01-29 実験手法 X-RAY DIFFRACTION (1.16 Å) 主引用文献 Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties. Sci Rep, 9, 2019
5E52	Crystal structure of human CNTN5 FN1-FN3 domains 分子名称: Contactin-5, PHOSPHATE ION 著者 Nikolaienko, R.M, Bouyain, S. 登録日 2015-10-07 公開日 2016-08-31 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.685 Å) 主引用文献 Structural Basis for Interactions Between Contactin Family Members and Protein-tyrosine Phosphatase Receptor Type G in Neural Tissues. J.Biol.Chem., 291, 2016
5E58	Crystal Structure Of Cytochrome P450 2B35 from Desert Woodrat Neotoma Lepida in complex with 4-(4-chlorophenyl)imidazole 分子名称: 4-(4-CHLOROPHENYL)IMIDAZOLE, 5-CYCLOHEXYL-1-PENTYL-BETA-D-MALTOSIDE, Cytochrome P450 family 2 subfamily B, ... 著者 Shah, M.B, Stout, C.D, Halpert, J.R. 登録日 2015-10-08 公開日 2016-02-10 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Structure-Function Analysis of Mammalian CYP2B Enzymes Using 7-Substituted Coumarin Derivatives as Probes: Utility of Crystal Structures and Molecular Modeling in Understanding Xenobiotic Metabolism. Mol.Pharmacol., 89, 2016
5EBH	Crystal Structure HEW Lysozyme processed with the CrystalDirect automated mounting and cryo-cooling technology 分子名称: Lysozyme C 著者 Zander, U, Hoffmann, G, Cornaciu, I, Marquez, J.A. 登録日 2015-10-19 公開日 2016-04-13 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.2 Å) 主引用文献 Automated harvesting and processing of protein crystals through laser photoablation. Acta Crystallogr D Struct Biol, 72, 2016
6SGH	Nek2 kinase covalently bound to 2-arylamino-6-ethynylpurine inhibitor 66 分子名称: 2-[4-[(6-ethenyl-9~{H}-purin-2-yl)amino]phenyl]ethanamide, Serine/threonine-protein kinase Nek2 著者 Richards, M.W, Mas-Droux, C.P, Bayliss, R. 登録日 2019-08-04 公開日 2020-06-17 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 2-Arylamino-6-ethynylpurines are cysteine-targeting irreversible inhibitors of Nek2 kinase. Rsc Med Chem, 11, 2020
6SYE	Crystal structure of orthorhombic lysozyme in presence of the dye bromophenol blue at pH 7.0 分子名称: CHLORIDE ION, Lysozyme C, bromophenol blue 著者 Camara-Artigas, A, Plaza-Garrido, M, Salinas-Garcia, M.C. 登録日 2019-09-27 公開日 2020-09-09 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (0.97 Å) 主引用文献 Lysozyme crystals dyed with bromophenol blue: where has the dye gone? Acta Crystallogr D Struct Biol, 76, 2020
5E7L	Crystal structure of mouse CNTN2 FN1-FN3 domains 分子名称: Contactin-2 著者 Nikolaienko, R.M, Bouyain, S. 登録日 2015-10-12 公開日 2016-08-31 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (2.002 Å) 主引用文献 Structural Basis for Interactions Between Contactin Family Members and Protein-tyrosine Phosphatase Receptor Type G in Neural Tissues. J.Biol.Chem., 291, 2016
5EAF	Saccharomyces cerevisiae CYP51 complexed with the plant pathogen inhibitor Fluquinconazole 分子名称: 3-(2,4-dichlorophenyl)-6-fluoranyl-2-(1,2,4-triazol-1-yl)quinazolin-4-one, Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE 著者 Tyndall, J.D.A, Sabherwal, M, Sagatova, A.A, Keniya, M.V, Wilson, R.K, Woods, M.V, Monk, B.C. 登録日 2015-10-16 公開日 2016-02-10 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.65 Å) 主引用文献 Structural and Functional Elucidation of Yeast Lanosterol 14 alpha-Demethylase in Complex with Agrochemical Antifungals. PLoS ONE, 11, 2016
6SMA	Crystal structure of Human Neutrophil Elastase (HNE) in complex with the 3-Oxo-beta-Sultam inhibitor LMC249 分子名称: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, 3-[[1-[(4-bromophenyl)methyl]-1,2,3-triazol-4-yl]methylcarbamoyl]pentane-3-sulfonic acid, ... 著者 Brito, J.A, Almeida, V.T, Carvalho, L.M, Moreira, R, Archer, M. 登録日 2019-08-21 公開日 2020-04-08 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.59 Å) 主引用文献 3-Oxo-beta-sultam as a Sulfonylating Chemotype for Inhibition of Serine Hydrolases and Activity-Based Protein Profiling. Acs Chem.Biol., 15, 2020
6SHH	Human kallikrein 7 with aromatic coumarinic ester compound 1 covalently bound to H57 分子名称: (3-chlorophenyl) 6-methyl-2-oxidanylidene-chromene-3-carboxylate, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, Kallikrein-7, ... 著者 Hanke, S, Straeter, N. 登録日 2019-08-06 公開日 2020-05-20 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Structural Studies on the Inhibitory Binding Mode of Aromatic Coumarinic Esters to Human Kallikrein-Related Peptidase 7. J.Med.Chem., 63, 2020
6SOV	Fragments KCL_615 and KCL_802 in complex with MAP kinase p38-alpha 分子名称: (5~{S},7~{R})-3-azanyladamantan-1-ol, 4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)-5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE, 6-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]pyridine-3-sulfonamide, ... 著者 Nichols, C.E, De Nicola, G.F. 登録日 2019-08-30 公開日 2019-10-02 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.31 Å) 主引用文献 Mining the PDB for Tractable Cases Where X-ray Crystallography Combined with Fragment Screens Can Be Used to Systematically Design Protein-Protein Inhibitors: Two Test Cases Illustrated by IL1 beta-IL1R and p38 alpha-TAB1 Complexes. J.Med.Chem., 63, 2020
6SR3	X-ray pump X-ray probe on lysozyme.Gd nanocrystals: 62 fs time delay 分子名称: 10-((2R)-2-HYDROXYPROPYL)-1,4,7,10-TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID, CHLORIDE ION, GADOLINIUM ATOM, ... 著者 Kloos, M, Gorel, A, Nass, K. 登録日 2019-09-04 公開日 2020-04-22 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structural dynamics in proteins induced by and probed with X-ray free-electron laser pulses. Nat Commun, 11, 2020
5E8S	TGF-BETA RECEPTOR TYPE 1 KINASE DOMAIN (WT) 分子名称: TGF-beta receptor type-1 著者 Sheriff, S. 登録日 2015-10-14 公開日 2016-05-11 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Crystal structures of apo and inhibitor-bound TGF beta R2 kinase domain: insights into TGF beta R isoform selectivity. Acta Crystallogr D Struct Biol, 72, 2016
5E2P	FACTOR XIA IN COMPLEX WITH THE INHIBITOR N-[(1S)-1-benzyl-2-[2-[5-chloro-2-(tetrazol-1-yl)phenyl]ethylamino]-2-oxo-ethyl]-4-hydroxy-2-oxo-1H-quinoline-6-carboxamide 分子名称: 1,2-ETHANEDIOL, Coagulation factor XIa light chain, N-[(1S)-1-benzyl-2-[2-[5-chloro-2-(tetrazol-1-yl)phenyl]ethylamino]-2-oxo-ethyl]-4-hydroxy-2-oxo-1H-quinoline-6-carboxamide, ... 著者 Wei, A. 登録日 2015-10-01 公開日 2015-12-09 最終更新日 2016-01-20 実験手法 X-RAY DIFFRACTION (2.11 Å) 主引用文献 Novel phenylalanine derived diamides as Factor XIa inhibitors. Bioorg.Med.Chem.Lett., 26, 2016
5E8Z	TGF-BETA RECEPTOR TYPE 1 KINASE DOMAIN (T204D) IN COMPLEX WITH 3-AMINO-6-[4-(2-HYDROXYETHYL)PHENYL]-N-[4-(MORPHOLIN-4-YL)PYRIDIN-3-YL]PYRAZINE-2-CARBOXAMIDE 分子名称: 3-amino-6-[4-(2-hydroxyethyl)phenyl]-N-[4-(morpholin-4-yl)pyridin-3-yl]pyrazine-2-carboxamide, TGF-beta receptor type-1 著者 Sheriff, S. 登録日 2015-10-14 公開日 2016-05-11 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.51 Å) 主引用文献 Crystal structures of apo and inhibitor-bound TGF beta R2 kinase domain: insights into TGF beta R isoform selectivity. Acta Crystallogr D Struct Biol, 72, 2016
5EAB	Saccharomyces cerevisiae CYP51 complexed with the plant pathogen inhibitor S-tebuconazole 分子名称: (3~{S})-1-(4-chlorophenyl)-4,4-dimethyl-3-(1,2,4-triazol-1-ylmethyl)pentan-3-ol, Lanosterol 14-alpha demethylase, PROTOPORPHYRIN IX CONTAINING FE 著者 Tyndall, J.D.A, Sabherwal, M, Sagatova, A.A, Keniya, M.V, Wilson, R.K, Woods, M.V, Monk, B.C. 登録日 2015-10-16 公開日 2016-02-10 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Structural and Functional Elucidation of Yeast Lanosterol 14 alpha-Demethylase in Complex with Agrochemical Antifungals. PLoS ONE, 11, 2016
6SVD	Non-terahertz irradiated structure of bovine trypsin (even frames of crystal x41) 分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... 著者 Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G. 登録日 2019-09-18 公開日 2020-01-22 最終更新日 2020-01-29 実験手法 X-RAY DIFFRACTION (1.15 Å) 主引用文献 Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties. Sci Rep, 9, 2019
6SVW	Reference structure of bovine trypsin (even frames of crystal x33) 分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... 著者 Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G. 登録日 2019-09-19 公開日 2020-01-22 最終更新日 2020-01-29 実験手法 X-RAY DIFFRACTION (1.16 Å) 主引用文献 Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties. Sci Rep, 9, 2019
6SW0	Reference structure of bovine trypsin (odd frames of crystal x34) 分子名称: BENZAMIDINE, CALCIUM ION, Cationic trypsin, ... 著者 Ahlberg Gagner, V, Lundholm, I, Garcia-Bonete, M.J, Rodilla, H, Friedman, R, Zhaunerchyk, V, Bourenkov, G, Schneider, T, Stake, J, Katona, G. 登録日 2019-09-19 公開日 2020-01-22 最終更新日 2020-01-29 実験手法 X-RAY DIFFRACTION (1.15 Å) 主引用文献 Clustering of atomic displacement parameters in bovine trypsin reveals a distributed lattice of atoms with shared chemical properties. Sci Rep, 9, 2019
6SR0	X-ray pump X-ray probe on lysozyme.Gd nanocrystals: single colour reference data 分子名称: 10-((2R)-2-HYDROXYPROPYL)-1,4,7,10-TETRAAZACYCLODODECANE 1,4,7-TRIACETIC ACID, CHLORIDE ION, GADOLINIUM ATOM, ... 著者 Kloos, M, Gorel, A, Nass, K. 登録日 2019-09-04 公開日 2020-04-22 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structural dynamics in proteins induced by and probed with X-ray free-electron laser pulses. Nat Commun, 11, 2020
5EU2	Crystal structure of murine neuroglobin mutant V101F at ambient pressure 分子名称: Neuroglobin, PROTOPORPHYRIN IX CONTAINING FE, SULFATE ION 著者 Colloc'h, N, Girard, E, Vallone, B, Prange, T. 登録日 2015-11-18 公開日 2016-10-19 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Determinants of neuroglobin plasticity highlighted by joint coarse-grained simulations and high pressure crystallography. Sci Rep, 7, 2017
6V6L	Co-structure of human glycogen synthase kinase beta with 1-(6-((2-((6-amino-5-nitropyridin-2-yl)amino)ethyl)amino)-2-(2,4-dichlorophenyl)pyridin-3-yl)-4-methylpiperazin-2-one 分子名称: 1-(6-((2-((6-amino-5-nitropyridin-2-yl)amino)ethyl)amino)-2-(2,4-dichlorophenyl)pyridin-3-yl)-4-methylpiperazin-2-one, Glycogen synthase kinase-3 beta, PHOSPHATE ION 著者 Bussiere, D.E, Fang, E, Shu, W. 登録日 2019-12-05 公開日 2020-01-15 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (2.19 Å) 主引用文献 Discovery and optimization of novel pyridines as highly potent and selective glycogen synthase kinase 3 inhibitors. Bioorg.Med.Chem.Lett., 30, 2020
5F3H	Structure of myostatin in complex with humanized RK35 antibody 分子名称: Growth/differentiation factor 8, humanized RK35 antibody heavy chain, humanized RK35 antibody light chain 著者 Parris, K.D, Mosyak, L. 登録日 2015-12-02 公開日 2016-09-28 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Beyond CDR-grafting: Structure-guided humanization of framework and CDR regions of an anti-myostatin antibody. Mabs, 8, 2016
6V6V	Crystal structure of oncogenic RhoA mutant G14V complexed with GDP 分子名称: 1,4-DIETHYLENE DIOXIDE, GUANOSINE-5'-DIPHOSPHATE, MAGNESIUM ION, ... 著者 Lin, Y, Zheng, Y. 登録日 2019-12-06 公開日 2020-12-23 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Structure of an inactive conformation of GTP-bound RhoA GTPase. Structure, 29, 2021

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