PDB: 12119 件ウェブページステータス検索Chemie searchBIRD

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2KI5	HERPES SIMPLEX TYPE-1 THYMIDINE KINASE IN COMPLEX WITH THE DRUG ACICLOVIR AT 1.9A RESOLUTION 分子名称: 9-HYROXYETHOXYMETHYLGUANINE, PROTEIN (THYMIDINE KINASE), SULFATE ION 著者 Bennett, M.S, Wien, F, Champness, J.N, Batuwangala, T, Rutherford, T, Summers, W.C, Sun, H, Wright, G, Sanderson, M.R. 登録日 1999-02-12 公開日 1999-03-04 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structure to 1.9 A resolution of a complex with herpes simplex virus type-1 thymidine kinase of a novel, non-substrate inhibitor: X-ray crystallographic comparison with binding of aciclovir. FEBS Lett., 443, 1999
6WPR	Crystal structure of a putative 3-oxoacyl-ACP reductase (FabG) with NADP(H) from Acinetobacter baumannii 分子名称: 3-oxoacyl-[acyl-carrier-protein] reductase, NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE 著者 Cross, E.M, Forwood, J.K. 登録日 2020-04-27 公開日 2020-06-10 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Insights into Acinetobacter baumannii fatty acid synthesis 3-oxoacyl-ACP reductases. Sci Rep, 11, 2021
1U62	NMR structure analysis of the lactoferrin-based peptide FQWQRNIRKVR in complex with lipopolysaccharide 分子名称: lactoferrin-based peptide 著者 Japelj, B, Pristovsek, P, Majerle, A, Jerala, R. 登録日 2004-07-29 公開日 2005-03-22 最終更新日 2020-06-24 実験手法 SOLUTION NMR 主引用文献 Structural Origin of Endotoxin Neutralization and Antimicrobial Activity of a Lactoferrin-based Peptide J.Biol.Chem., 280, 2005
2CK1	The structure of oxidised cyclophilin A from s. mansoni 分子名称: ACETATE ION, PEPTIDYL-PROLYL CIS-TRANS ISOMERASE E 著者 Gourlay, L.J, Angelucci, F, Bellelli, A, Boumis, G, Miele, A.E, Brunori, M. 登録日 2006-04-10 公開日 2007-05-15 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 The Three-Dimensional Structure of Two Redox States of Cyclophilin-A from Schistosoma Mansoni: Evidence for Redox- Regulation of Peptidyl-Prolyl Cis-Trans Isomerase Activity. J.Biol.Chem., 282, 2007
2BOA	Human procarboxypeptidase A4. 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, CARBOXYPEPTIDASE A4, ... 著者 Garcia-Castellanos, R, Bonet-Figueredo, R, Pallares, I, Ventura, S, Aviles, F.X, Vendrell, J, Gomis-Ruth, F.X. 登録日 2005-04-08 公開日 2005-12-13 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Detailed Molecular Comparison between the Inhibition Mode of A/B-Type Carboxypeptidases in the Zymogen State and by the Endogenous Inhibitor Latexin. Cell.Mol.Life Sci., 62, 2005
2CMT	The structure of reduced cyclophilin A from s. mansoni 分子名称: ACETATE ION, PEPTIDYL-PROLYL CIS-TRANS ISOMERASE E 著者 Gourlay, L.J, Angelucci, F, Bellelli, A, Boumis, G, Miele, A.E, Brunori, M. 登録日 2006-05-12 公開日 2007-05-15 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 The Three-Dimensional Structure of Two Redox States of Cyclophilin a from Schistosoma Mansoni. Evidence for Redox Regulation of Peptidyl-Prolyl Cis-Trans Isomerase Activity. J.Biol.Chem., 282, 2007
5X2A	Crystal structure of EGFR 696-1022 T790M/V948R in complex with SKLB(3) 分子名称: 1,2-ETHANEDIOL, CHLORIDE ION, Epidermal growth factor receptor, ... 著者 Yun, C.H. 登録日 2017-01-31 公開日 2018-02-07 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Structural insights into drug development strategy targeting EGFR T790M/C797S. Oncotarget, 9, 2018
5X26	Crystal structure of EGFR 696-1022 L858R in complex with SKLB(3) 分子名称: CHLORIDE ION, Epidermal growth factor receptor, N2-[4-(4-methylpiperazin-1-yl)phenyl]-N8-phenyl-9-propan-2-yl-purine-2,8-diamine 著者 Yun, C.H. 登録日 2017-01-31 公開日 2018-02-07 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.951 Å) 主引用文献 Structural insights into drug development strategy targeting EGFR T790M/C797S. Oncotarget, 9, 2018
5X2K	Crystal structure of EGFR 696-1022 T790M in complex with WZ4003 分子名称: Epidermal growth factor receptor, N-{3-[(5-chloro-2-{[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-4-yl)oxy]phenyl}prop-2-enamide 著者 Zhu, S.J, Zhao, P, Yun, C.H. 登録日 2017-02-01 公開日 2018-02-21 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (3.201 Å) 主引用文献 Structural insights into drug development strategy targeting EGFR T790M/C797S. Oncotarget, 9, 2018
1XV4	Solution structure of antimicrobial and endotoxin-neutralizing peptide Lf11 in SDS micelles 分子名称: lactoferrin-based synthetic peptide FQWQRNIRKVR 著者 Japelj, B, Pristovsek, P, Majerle, A, Jerala, R. 登録日 2004-10-27 公開日 2005-03-22 最終更新日 2020-06-24 実験手法 SOLUTION NMR 主引用文献 Structural origin of endotoxin neutralization and antimicrobial activity of a lactoferrin-based peptide J.Biol.Chem., 280, 2005
1XV7	Solution structure of antimicrobial and endotoxin-neutralizing peptide Lf11 in DPC micelles 分子名称: lactoferrin-based synthetic peptide FQWQRNIRKVR 著者 Japelj, B, Pristovsek, P, Majerle, A, Jerala, R. 登録日 2004-10-27 公開日 2005-03-22 最終更新日 2020-06-24 実験手法 SOLUTION NMR 主引用文献 Structural origin of endotoxin neutralization and antimicrobial activity of a lactoferrin-based peptide J.Biol.Chem., 280, 2005
5X28	Crystal structure of EGFR 696-1022 L858R in complex with SKLB(6) 分子名称: 9-cyclohexyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N8-phenyl-purine-2,8-diamine, CHLORIDE ION, Epidermal growth factor receptor 著者 Yun, C.H. 登録日 2017-01-31 公開日 2018-02-07 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.952 Å) 主引用文献 Structural insights into drug development strategy targeting EGFR T790M/C797S. Oncotarget, 9, 2018
5X2C	Crystal structure of EGFR 696-1022 T790M/V948R in complex with SKLB(5) 分子名称: 1,2-ETHANEDIOL, 9-cyclopentyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N8-phenyl-purine-2,8-diamine, CHLORIDE ION, ... 著者 Yun, C.H. 登録日 2017-01-31 公開日 2018-02-21 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (2.05 Å) 主引用文献 Structural insights into drug development strategy targeting EGFR T790M/C797S. Oncotarget, 9, 2018
5X2F	Crystal structure of EGFR 696-1022 T790M/V948R in complex with SKLB(6) 分子名称: 9-cyclohexyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N8-phenyl-purine-2,8-diamine, Epidermal growth factor receptor 著者 Yun, C.H. 登録日 2017-01-31 公開日 2018-02-07 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Structural insights into drug development strategy targeting EGFR T790M/C797S. Oncotarget, 9, 2018
5X27	Crystal structure of EGFR 696-1022 L858R in complex with SKLB(5) 分子名称: 9-cyclopentyl-N2-[4-(4-methylpiperazin-1-yl)phenyl]-N8-phenyl-purine-2,8-diamine, CHLORIDE ION, Epidermal growth factor receptor 著者 Yun, C.H. 登録日 2017-01-31 公開日 2018-02-07 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.952 Å) 主引用文献 Structural insights into drug development strategy targeting EGFR T790M/C797S. Oncotarget, 9, 2018
8G2E	PKM2 bound to compound 2 分子名称: 1,2-ETHANEDIOL, 3-[(3-aminophenyl)methyl]-5-methyl-7-[methyl(oxidanyl)-$l^{3}-sulfanyl]pyridazino[4,5-b]indol-4-one, MAGNESIUM ION, ... 著者 Stuckey, J.A. 登録日 2023-02-03 公開日 2023-05-17 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.838 Å) 主引用文献 Development of Novel Small-Molecule Activators of Pyruvate Kinase Muscle Isozyme 2, PKM2, to Reduce Photoreceptor Apoptosis. Pharmaceuticals, 16, 2023
3LTW	The structure of mycobacterium marinum arylamine n-acetyltransferase in complex with hydralazine 分子名称: 1-hydrazinophthalazine, Arylamine N-acetyltransferase Nat, FORMIC ACID 著者 Abuhammad, A.M, Lowe, E.D, Fullam, E, Noble, M, Garman, E.F, Sim, E. 登録日 2010-02-16 公開日 2010-07-07 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Probing the architecture of the Mycobacterium marinum arylamine N-acetyltransferase active site Protein Cell, 1, 2010
7RD0	Crystal structure of C. difficile penicillin-binding protein 3 in apo form 分子名称: GLYCEROL, Penicillin-binding protein, ZINC ION 著者 Sacco, M, Chen, Y. 登録日 2021-07-08 公開日 2022-03-23 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 A unique class of Zn 2+ -binding serine-based PBPs underlies cephalosporin resistance and sporogenesis in Clostridioides difficile. Nat Commun, 13, 2022
7RCX	Crystal structure of C. difficile penicillin-binding protein 2 in apo form 分子名称: GLYCEROL, Penicillin-binding protein, SULFATE ION, ... 著者 Sacco, M, Chen, Y. 登録日 2021-07-08 公開日 2022-03-23 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.85 Å) 主引用文献 A unique class of Zn 2+ -binding serine-based PBPs underlies cephalosporin resistance and sporogenesis in Clostridioides difficile. Nat Commun, 13, 2022
7RCW	Crystal structure of C. difficile penicillin-binding protein 2 in complex with ampicillin 分子名称: (2R,4S)-2-[(R)-{[(2R)-2-amino-2-phenylacetyl]amino}(carboxy)methyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, ACETATE ION, DI(HYDROXYETHYL)ETHER, ... 著者 Sacco, M, Chen, Y. 登録日 2021-07-08 公開日 2022-03-23 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 A unique class of Zn 2+ -binding serine-based PBPs underlies cephalosporin resistance and sporogenesis in Clostridioides difficile. Nat Commun, 13, 2022
7RCZ	Crystal structure of C. difficile SpoVD in complex with ampicillin 分子名称: (2R,4S)-2-[(R)-{[(2R)-2-amino-2-phenylacetyl]amino}(carboxy)methyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, DI(HYDROXYETHYL)ETHER, ... 著者 Sacco, M, Chen, Y. 登録日 2021-07-08 公開日 2022-03-23 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 A unique class of Zn 2+ -binding serine-based PBPs underlies cephalosporin resistance and sporogenesis in Clostridioides difficile. Nat Commun, 13, 2022
7RCY	Crystal structure of C. difficile penicillin-binding protein 2 in complex with ceftobiprole 分子名称: (2R)-2-[(1R)-1-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(hydroxyimino)acetyl]amino}-2-oxoethyl]-5-({2-oxo-1-[(3R)-pyr rolidin-3-yl]-2,5-dihydro-1H-pyrrol-3-yl}methyl)-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid, Penicillin-binding protein, ZINC ION 著者 Sacco, M, Chen, Y. 登録日 2021-07-08 公開日 2022-03-23 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 A unique class of Zn 2+ -binding serine-based PBPs underlies cephalosporin resistance and sporogenesis in Clostridioides difficile. Nat Commun, 13, 2022
6UDS	Crystal structure of a putative 3-oxoacyl-ACP reductase (FabG) from Acinetobacter baumannii 分子名称: 3-oxoacyl-(Acyl-carrier-protein) reductase 著者 Forwood, J.K, Cross, E.M. 登録日 2019-09-19 公開日 2019-10-09 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Insights into Acinetobacter baumannii fatty acid synthesis 3-oxoacyl-ACP reductases. Sci Rep, 11, 2021
6UUV	Crystal structure of a high molecular weight 3-oxoacyl-ACP reductase (FabG) from Acinetobacter baumannii crystal form 1 分子名称: 3-ketoacyl-ACP reductase 著者 Cross, E.M, Forwood, J.K. 登録日 2019-11-01 公開日 2019-12-04 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Insights into Acinetobacter baumannii fatty acid synthesis 3-oxoacyl-ACP reductases. Sci Rep, 11, 2021
6UUT	Crystal structure of a high molecular weight 3-oxoacyl-ACP reductase (FabG) from Acinetobacter baumannii crystal form 2 分子名称: 3-ketoacyl-ACP reductase 著者 Cross, E.M, Forwood, J.K. 登録日 2019-10-31 公開日 2019-12-04 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Insights into Acinetobacter baumannii fatty acid synthesis 3-oxoacyl-ACP reductases. Sci Rep, 11, 2021

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