PDB: 242842 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
4X1J	X-ray crystal structure of the dimeric BMP antagonist NBL1 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Neuroblastoma suppressor of tumorigenicity 1 著者 Thompson, T.B, Nolan, K, Kattamuri, C. 登録日 2014-11-24 公開日 2015-01-14 最終更新日 2024-11-20 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Structure of Neuroblastoma Suppressor of Tumorigenicity 1 (NBL1): INSIGHTS FOR THE FUNCTIONAL VARIABILITY ACROSS BONE MORPHOGENETIC PROTEIN (BMP) ANTAGONISTS. J.Biol.Chem., 290, 2015
4WKA	Crystal structure of human chitotriosidase-1 catalytic domain at 0.95 A resolution 分子名称: Chitotriosidase-1, L(+)-TARTARIC ACID 著者 Fadel, F, Zhao, Y, Cachau, R, Cousido-Siah, A, Ruiz, F.X, Harlos, K, Howard, E, Mitschler, A, Podjarny, A. 登録日 2014-10-02 公開日 2015-07-08 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (0.95 Å) 主引用文献 New insights into the enzymatic mechanism of human chitotriosidase (CHIT1) catalytic domain by atomic resolution X-ray diffraction and hybrid QM/MM. Acta Crystallogr.,Sect.D, 71, 2015
7PA1	Structure of N-acetylglucosamine kinase from Plesiomonas shigelloides in complex with AMP-PNP in the absence of N-acetylglucoseamine substrate 分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER, ... 著者 Roy, S, Isupov, M.N, Harmer, N.J, Ames, J.R. 登録日 2021-07-28 公開日 2022-08-10 最終更新日 2024-02-07 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Spinning sugars in antigen biosynthesis: characterization of the Coxiella burnetii and Streptomyces griseus TDP-sugar epimerases J.Biol.Chem., 2022
6OD0	Structure of human CIB1 in complex with peptide inhibitor UNC10245092 分子名称: CALCIUM ION, Calcium and integrin-binding protein 1, Peptide inhibitor UNC10245092 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 (2.15 Å) 主引用文献 Discovery and Characterization of Peptide Inhibitors for Calcium and Integrin Binding Protein 1. Acs Chem.Biol., 15, 2020
4X1N	The crystal structure of mupain-1-16 in complex with murinised human uPA at pH7.4 分子名称: Urokinase-type plasminogen activator, mupain-1-16, piperidine-1-carboximidamide 著者 Jiang, L, Zhao, B, Xu, P, Andreasen, P, Huang, M. 登録日 2014-11-25 公開日 2015-03-25 最終更新日 2025-09-17 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 A cyclic peptidic serine protease inhibitor: increasing affinity by increasing peptide flexibility. Plos One, 9, 2014
7PUE	Human serum and glucocorticoid-regulated kinase 1 in complex with pyrazolopyridine inhibitor 3a 分子名称: 6-[4-[[2,3-bis(chloranyl)phenyl]sulfonylamino]phenyl]-~{N}-[(3~{R})-pyrrolidin-3-yl]-2~{H}-pyrazolo[3,4-b]pyridine-4-carboxamide, GLYCEROL, Serine/threonine-protein kinase Sgk1 著者 Dreyer, M.K, Halland, N, Nazare, M. 登録日 2021-09-29 公開日 2021-12-01 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (2.506 Å) 主引用文献 Rational Design of Highly Potent, Selective, and Bioavailable SGK1 Protein Kinase Inhibitors for the Treatment of Osteoarthritis. J.Med.Chem., 65, 2022
377D	5'-R(*CP*GP*UP*AP*CP*DG)-3' 分子名称: RNA-DNA (5'-R(*CP*GP*UP*AP*CP*DG)-3') 著者 Biswas, R, Mitra, S.N, Sundaralingam, M. 登録日 1998-01-26 公開日 1998-08-10 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (1.76 Å) 主引用文献 1.76 A structure of a pyrimidine start alternating A-RNA hexamer r(CGUAC)dG. Acta Crystallogr.,Sect.D, 54, 1998
6OZQ	Crystal structure of Mus musculus (Mm) Endonuclease V (K155M) in complex with a 23mer RNA oligo containing an inosine after a 100 min soak in 10 mM Mn2+ and K+ 分子名称: 1,2-ETHANEDIOL, 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'), Endonuclease V, ... 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 (2.153 Å) 主引用文献 Evolution of Inosine-Specific Endonuclease V from Bacterial DNase to Eukaryotic RNase. Mol.Cell, 76, 2019
6PK2	CRYSTAL STRUCTURE OF THE CARBOXYLTRANSFERASE SUBUNIT OF ACC (ACCD6) IN COMPLEX WITH INHIBITOR QUIZALOFOP-P derivative FROM MYCOBACTERIUM TUBERCULOSIS 分子名称: 2-{4-[(6-fluoro-1,3-benzothiazol-2-yl)oxy]-2-hydroxyphenyl}-N-methylacetamide, Propionyl-CoA carboxylase subunit beta 著者 Reddy, M.C.M, Nian, Z, Michele, T.C.B, Sacchettini, J.C, TB Structural Genomics Consortium (TBSGC) 登録日 2019-06-28 公開日 2020-07-01 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.402 Å) 主引用文献 Elucidating the Inhibition and specificity of binding of herbicidal aryloxyphenoxypropionates derivatives to Mycobacterium tuberculosis carboxyltransferase domain of acetyl-coenzyme A(AccD6). To Be Published
4WXI	FACTOR XIA IN COMPLEX WITH THE INHIBITOR trans-N-{(1S)-1-[4-(3-amino-2H-indazol-6-yl)pyridin-2-yl]-2-phenylethyl}-4-(aminomethyl)cyclohexanecarboxamide 分子名称: 1,2-ETHANEDIOL, COAGULATION FACTOR XI, LIGHT CHAIN, ... 著者 Wei, A. 登録日 2014-11-13 公開日 2015-01-28 最終更新日 2024-11-13 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Pyridine and pyridinone-based factor XIa inhibitors. Bioorg.Med.Chem.Lett., 25, 2015
7PWI	Structure of the dTDP-sugar epimerase StrM 分子名称: 1,2-ETHANEDIOL, CALCIUM ION, dTDP-4-keto-rhamnose 3,5-epimerase,dTDP-4-dehydrorhamnose 3,5-epimerase 著者 Cross, A.R, Harmer, N.J, Isupov, M.N. 登録日 2021-10-06 公開日 2022-04-20 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.326 Å) 主引用文献 Spinning sugars in antigen biosynthesis: characterization of the Coxiella burnetii and Streptomyces griseus TDP-sugar epimerases. J.Biol.Chem., 298, 2022
4WYO	Crystal structure of human-yeast chimera acetyl coA carboxylase CT domain bound to Compound 1 分子名称: 2'-tert-butyl-1-(2H-indazol-5-ylcarbonyl)-2'H-spiro[piperidine-4,5'-pyrano[3,2-c]pyrazol]-7'(6'H)-one, Acetyl-CoA carboxylase 著者 Vajdos, F.F. 登録日 2014-11-17 公開日 2015-01-14 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.89 Å) 主引用文献 Decreasing the Rate of Metabolic Ketone Reduction in the Discovery of a Clinical Acetyl-CoA Carboxylase Inhibitor for the Treatment of Diabetes. J.Med.Chem., 57, 2014
7Q52	Crystal structure of S/T protein kinase PknG from Mycobacterium tuberculosis in complex with inhibitor L2W 分子名称: 2-azanyl-3-(4-fluorophenyl)carbonyl-indolizine-1-carboxamide, FE (III) ION, SODIUM ION, ... 著者 Defelipe, L.A, Burastero, O, Bento, I, Garcia-Alai, M.M. 登録日 2021-11-02 公開日 2022-06-22 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (2.35 Å) 主引用文献 Cosolvent Sites-Based Discovery of Mycobacterium Tuberculosis Protein Kinase G Inhibitors. J.Med.Chem., 65, 2022
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
4X1S	The crystal structure of mupain-1-16-D9A in complex with murinised human uPA at pH7.4 分子名称: Urokinase-type plasminogen activator, mupain-1-16, piperidine-1-carboximidamide 著者 Jiang, L, Zhao, B, Xu, P, Andreasen, P, Huang, M. 登録日 2014-11-25 公開日 2015-10-28 最終更新日 2025-09-17 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 A cyclic peptidic serine protease inhibitor: increasing affinity by increasing peptide flexibility. Plos One, 9, 2014
7PZ4	Structure of an LPMO at 2.07x10^4 Gy 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ACRYLIC ACID, ... 著者 Tandrup, T, Muderspach, S.J, Ipsen, J.O, Johansen, K.S, Lo Leggio, L. 登録日 2021-10-11 公開日 2022-08-24 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 Changes in active-site geometry on X-ray photoreduction of a lytic polysaccharide monooxygenase active-site copper and saccharide binding. Iucrj, 9, 2022
7PZ6	Structure of an LPMO at 2.22x10^5 Gy 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ACRYLIC ACID, ... 著者 Tandrup, T, Muderspach, S.J, Ipsen, J.O, Johansen, K.S, Lo Leggio, L. 登録日 2021-10-11 公開日 2022-08-24 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Changes in active-site geometry on X-ray photoreduction of a lytic polysaccharide monooxygenase active-site copper and saccharide binding. Iucrj, 9, 2022
7PZ5	Structure of an LPMO at 9.56x10^4 Gy 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ACRYLIC ACID, ... 著者 Tandrup, T, Muderspach, S.J, Ipsen, J.O, Johansen, K.S, Lo Leggio, L. 登録日 2021-10-11 公開日 2022-08-24 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 Changes in active-site geometry on X-ray photoreduction of a lytic polysaccharide monooxygenase active-site copper and saccharide binding. Iucrj, 9, 2022
7PZ8	Structure of an LPMO at 3.12x10^6 Gy 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, ACRYLIC ACID, ... 著者 Tandrup, T, Muderspach, S.J, Ipsen, J.O, Johansen, K.S, Lo Leggio, L. 登録日 2021-10-11 公開日 2022-08-24 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Changes in active-site geometry on X-ray photoreduction of a lytic polysaccharide monooxygenase active-site copper and saccharide binding. Iucrj, 9, 2022
4X9X	Biochemical Roles for Conserved Residues in the Bacterial Fatty Acid Binding Protein Family 分子名称: 1,2-ETHANEDIOL, DegV domain-containing protein MW1315, OLEIC ACID 著者 Broussard, T.C, Miller, D.J, Jackson, P, Nourse, A, Rock, C.O. 登録日 2014-12-11 公開日 2016-01-27 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.199 Å) 主引用文献 Biochemical Roles for Conserved Residues in the Bacterial Fatty Acid-binding Protein Family. J.Biol.Chem., 291, 2016
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
6HU6	Structure of ARF1 RNA 分子名称: AMMONIUM ION, RNA (19-MER), RNA (5'-R(*CP*UP*GP*GP*UP*AP*CP*UP*C)-3'), ... 著者 Emmerich, C, Lazzaretti, D, Bandholz-Cajamarca, L, Bono, F. 登録日 2018-10-05 公開日 2018-11-21 最終更新日 2024-05-15 実験手法 X-RAY DIFFRACTION (1.904 Å) 主引用文献 The crystal structure of Staufen1 in complex with a physiological RNA sheds light on substrate selectivity. Life Sci Alliance, 1, 2018
6OZN	Crystal structure of Mus musculus (Mm) Endonuclease V in complex with a 23mer RNA oligo containing an inosine after a 15 min soak in 10 mM Mn2+ 分子名称: 1,2-ETHANEDIOL, 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'), Endonuclease V, ... 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 (1.9 Å) 主引用文献 Evolution of Inosine-Specific Endonuclease V from Bacterial DNase to Eukaryotic RNase. Mol.Cell, 76, 2019
8GMK	Pyruvate bound structure of Citrate Synthase (CitA) in Mycobacterium Tuberculosis 分子名称: 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, PYRUVIC ACID, ... 著者 Pathirage, R, Ronning, D, Yamsek, M. 登録日 2023-03-26 公開日 2023-06-07 最終更新日 2023-11-15 実験手法 X-RAY DIFFRACTION (1.81 Å) 主引用文献 Mycobacterium tuberculosis CitA activity is modulated by cysteine oxidation and pyruvate binding. Rsc Med Chem, 14, 2023

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