3WKD
| Crystal structure of soluble epoxide hydrolase in complex with fragment inhibitor | 分子名称: | Bifunctional epoxide hydrolase 2, MAGNESIUM ION, N-[2-(morpholin-4-yl)phenyl]thiophene-3-carboxamide, ... | 著者 | Amano, Y, Yamaguchi, T, Tanabe, E. | 登録日 | 2013-10-18 | 公開日 | 2014-04-16 | 最終更新日 | 2022-08-24 | 実験手法 | X-RAY DIFFRACTION (2.48 Å) | 主引用文献 | Structural insights into binding of inhibitors to soluble epoxide hydrolase gained by fragment screening and X-ray crystallography. Bioorg.Med.Chem., 22, 2014
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3WKC
| Crystal structure of soluble epoxide hydrolase in complex with fragment inhibitor | 分子名称: | 4-{2,5-dimethyl-1-[(2R)-tetrahydrofuran-2-ylmethyl]-1H-pyrrol-3-yl}-1,3-thiazol-2-amine, Bifunctional epoxide hydrolase 2, MAGNESIUM ION, ... | 著者 | Amano, Y, Yamaguchi, T, Tanabe, E. | 登録日 | 2013-10-18 | 公開日 | 2014-04-16 | 最終更新日 | 2022-08-24 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Structural insights into binding of inhibitors to soluble epoxide hydrolase gained by fragment screening and X-ray crystallography. Bioorg.Med.Chem., 22, 2014
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3WK8
| Crystal structure of soluble epoxide hydrolase in complex with fragment inhibitor | 分子名称: | 6-(trifluoromethyl)-1,3-benzothiazol-2-amine, Bifunctional epoxide hydrolase 2, MAGNESIUM ION, ... | 著者 | Amano, Y, Yamaguchi, T, Tanabe, E. | 登録日 | 2013-10-17 | 公開日 | 2014-04-16 | 最終更新日 | 2022-08-24 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Structural insights into binding of inhibitors to soluble epoxide hydrolase gained by fragment screening and X-ray crystallography. Bioorg.Med.Chem., 22, 2014
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3WK5
| Crystal structure of soluble epoxide hydrolase in complex with fragment inhibitor | 分子名称: | 2-cyclopentyl-N-(1,3-thiazol-2-yl)acetamide, Bifunctional epoxide hydrolase 2, MAGNESIUM ION, ... | 著者 | Amano, Y, Yamaguchi, T, Tanabe, E. | 登録日 | 2013-10-17 | 公開日 | 2014-04-16 | 最終更新日 | 2022-08-24 | 実験手法 | X-RAY DIFFRACTION (2.77 Å) | 主引用文献 | Structural insights into binding of inhibitors to soluble epoxide hydrolase gained by fragment screening and X-ray crystallography. Bioorg.Med.Chem., 22, 2014
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3WK6
| Crystal structure of soluble epoxide hydrolase in complex with fragment inhibitor | 分子名称: | (5R)-5-methyl-N-(2-phenylethyl)-4,5-dihydro-1,3-thiazol-2-amine, Bifunctional epoxide hydrolase 2, MAGNESIUM ION, ... | 著者 | Amano, Y, Yamaguchi, T, Tanabe, E. | 登録日 | 2013-10-17 | 公開日 | 2014-04-16 | 最終更新日 | 2022-08-24 | 実験手法 | X-RAY DIFFRACTION (2.1 Å) | 主引用文献 | Structural insights into binding of inhibitors to soluble epoxide hydrolase gained by fragment screening and X-ray crystallography. Bioorg.Med.Chem., 22, 2014
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3WK4
| Crystal structure of soluble epoxide hydrolase in complex with fragment inhibitor | 分子名称: | 1-[(1R)-1-cyclopropylethyl]-3-phenylurea, Bifunctional epoxide hydrolase 2, MAGNESIUM ION, ... | 著者 | Amano, Y, Yamaguchi, T, Tanabe, E. | 登録日 | 2013-10-17 | 公開日 | 2014-04-16 | 最終更新日 | 2022-08-24 | 実験手法 | X-RAY DIFFRACTION (2.11 Å) | 主引用文献 | Structural insights into binding of inhibitors to soluble epoxide hydrolase gained by fragment screening and X-ray crystallography. Bioorg.Med.Chem., 22, 2014
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3WK7
| Crystal structure of soluble epoxide hydrolase in complex with fragment inhibitor | 分子名称: | 2-(1-methyl-1H-pyrazol-4-yl)-1H-benzimidazole, Bifunctional epoxide hydrolase 2, MAGNESIUM ION, ... | 著者 | Amano, Y, Yamaguchi, T, Tanabe, E. | 登録日 | 2013-10-17 | 公開日 | 2014-04-16 | 最終更新日 | 2022-08-24 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Structural insights into binding of inhibitors to soluble epoxide hydrolase gained by fragment screening and X-ray crystallography. Bioorg.Med.Chem., 22, 2014
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4C6H
| Haloalkane dehalogenase with 1-hexanol | 分子名称: | CHLORIDE ION, HALOALKANE DEHALOGENASE, HEXAN-1-OL, ... | 著者 | Novak, H.R, Sayer, C, Isupov, M, Gotz, D, Spragg, A.M, Littlechild, J.A. | 登録日 | 2013-09-18 | 公開日 | 2014-05-14 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (1.61 Å) | 主引用文献 | Biochemical and Structural Characterisation of a Haloalkane Dehalogenase from a Marine Rhodobacteraceae. FEBS Lett., 588, 2014
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4C4Z
| Crystal structure of human bifunctional epoxide hydroxylase 2 complexed with A8 | 分子名称: | 1-ethyl-3-naphthalen-1-ylurea, BIFUNCTIONAL EPOXIDE HYDROLASE 2 | 著者 | Pilger, J, Mazur, A, Monecke, P, Schreuder, H, Elshorst, B, Langer, T, Schiffer, A, Krimm, I, Wegstroth, M, Lee, D, Hessler, G, Wendt, K.-U, Becker, S, Griesinger, C. | 登録日 | 2013-09-09 | 公開日 | 2014-10-01 | 最終更新日 | 2024-05-08 | 実験手法 | X-RAY DIFFRACTION (2.06 Å) | 主引用文献 | A Combination of Spin Diffusion Methods for the Determination of Protein-Ligand Complex Structural Ensembles. Angew.Chem.Int.Ed.Engl., 54, 2015
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4C4Y
| Crystal structure of human bifunctional epoxide hydroxylase 2 complexed with A4 | 分子名称: | 1-(3-chlorophenyl)-3-(2-methoxyethyl)urea, BIFUNCTIONAL EPOXIDE HYDROLASE 2 | 著者 | Pilger, J, Mazur, A, Monecke, P, Schreuder, H, Elshorst, B, Langer, T, Schiffer, A, Krimm, I, Wegstroth, M, Lee, D, Hessler, G, Wendt, K.-U, Becker, S, Griesinger, C. | 登録日 | 2013-09-09 | 公開日 | 2014-10-01 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.41 Å) | 主引用文献 | A Combination of Spin Diffusion Methods for the Determination of Protein-Ligand Complex Structural Ensembles. Angew.Chem.Int.Ed.Engl., 54, 2015
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4C4X
| Crystal structure of human bifunctional epoxide hydroxylase 2 complexed with C9 | 分子名称: | 3-(3,4-dichlorophenyl)-1,1-dimethyl-urea, BIFUNCTIONAL EPOXIDE HYDROLASE 2 | 著者 | Pilger, J, Mazur, A, Monecke, P, Schreuder, H, Elshorst, B, Langer, T, Schiffer, A, Krimm, I, Wegstroth, M, Lee, D, Hessler, G, Wendt, K.-U, Becker, S, Griesinger, C. | 登録日 | 2013-09-09 | 公開日 | 2014-10-01 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (2.17 Å) | 主引用文献 | A Combination of Spin Diffusion Methods for the Determination of Protein-Ligand Complex Structural Ensembles. Angew.Chem.Int.Ed.Engl., 54, 2015
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3WIB
| Crystal structure of Y109W Mutant Haloalkane Dehalogenase DatA from Agrobacterium tumefaciens C58 | 分子名称: | 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, Haloalkane dehalogenase | 著者 | Guan, L.J, Yabuki, H, Okai, M, Ohtsuka, J, Tanokura, M. | 登録日 | 2013-09-09 | 公開日 | 2014-07-23 | 最終更新日 | 2022-08-24 | 実験手法 | X-RAY DIFFRACTION (1.95 Å) | 主引用文献 | Crystal structure of the novel haloalkane dehalogenase DatA from Agrobacterium tumefaciens C58 reveals a special halide-stabilizing pair and enantioselectivity mechanism. Appl.Microbiol.Biotechnol., 98, 2014
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3WI7
| Crystal Structure of the Novel Haloalkane Dehalogenase DatA from Agrobacterium tumefaciens C58 | 分子名称: | 2-[N-CYCLOHEXYLAMINO]ETHANE SULFONIC ACID, GLYCEROL, Haloalkane dehalogenase | 著者 | Guan, L.J, Yabuki, H, Okai, M, Ohtsuka, J, Tanokura, M. | 登録日 | 2013-09-06 | 公開日 | 2014-07-23 | 最終更新日 | 2022-08-24 | 実験手法 | X-RAY DIFFRACTION (1.7 Å) | 主引用文献 | Crystal structure of the novel haloalkane dehalogenase DatA from Agrobacterium tumefaciens C58 reveals a special halide-stabilizing pair and enantioselectivity mechanism. Appl.Microbiol.Biotechnol., 98, 2014
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4L9A
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4BRZ
| Haloalkane dehalogenase | 分子名称: | CHLORIDE ION, HALOALKANE DEHALOGENASE | 著者 | Novak, H.R, Sayer, C, Isupov, M, Gotz, D, Spragg, A.M, Littlechild, J.A. | 登録日 | 2013-06-06 | 公開日 | 2014-05-14 | 最終更新日 | 2023-12-20 | 実験手法 | X-RAY DIFFRACTION (1.67 Å) | 主引用文献 | Biochemical and Structural Characterisation of a Haloalkane Dehalogenase from a Marine Rhodobacteraceae. FEBS Lett., 588, 2014
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4KAF
| Crystal Structure of Haloalkane dehalogenase HaloTag7 at the resolution 1.5A, Northeast Structural Genomics Consortium (NESG) Target OR151 | 分子名称: | 1,2-ETHANEDIOL, DI(HYDROXYETHYL)ETHER, Haloalkane dehalogenase, ... | 著者 | Kuzin, A.P, Lew, S, Neklesa, T.K, Noblin, D, Seetharaman, J, Maglaqui, M, Xiao, R, Kohan, E, Wang, H, Everett, J.K, Acton, T.B, Kornhaber, G, Montelione, G.T, Crews, C, Tong, L, Northeast Structural Genomics Consortium (NESG) | 登録日 | 2013-04-22 | 公開日 | 2013-06-05 | 最終更新日 | 2023-12-06 | 実験手法 | X-RAY DIFFRACTION (1.496 Å) | 主引用文献 | Northeast Structural Genomics Consortium Target OR151 To be Published
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4KAA
| Crystal structure of the halotag2 protein at the resolution 2.3A, Northeast Structural Genomics Consortium (NESG) target OR150 | 分子名称: | DI(HYDROXYETHYL)ETHER, Haloalkane dehalogenase, SODIUM ION | 著者 | Kuzin, A, Lew, S, Neklesa, T.K, Noblin, D, Seetharaman, J, Maglaqui, M, Xiao, R, Kohan, E, Wang, H, Everett, J.K, Acton, T.B, Montelione, G.T, Hunt, J.F, Crews, C, Tong, L, Northeast Structural Genomics Consortium (NESG) | 登録日 | 2013-04-22 | 公開日 | 2013-06-05 | 最終更新日 | 2023-12-06 | 実験手法 | X-RAY DIFFRACTION (2.276 Å) | 主引用文献 | Northeast Structural Genomics Consortium Target OR150 To be Published
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4KAJ
| X-Ray Structure of the complex of Haloalkane dehalogenase HaloTag7 with HALTS, Northeast Structural Genomics Consortium (NESG) Target OR151 | 分子名称: | 1,2-ETHANEDIOL, GLYCEROL, MANGANESE (II) ION, ... | 著者 | Kuzin, A, Lew, S, Neklesa, T.K, Noblin, D, Seetharaman, J, Maglaqui, M, Xiao, R, Kohan, E, Wang, H, Everett, J.K, Acton, T.B, Kornhaber, G, Montelione, G.T, Crews, C.M, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG) | 登録日 | 2013-04-22 | 公開日 | 2013-06-05 | 最終更新日 | 2023-12-06 | 実験手法 | X-RAY DIFFRACTION (1.948 Å) | 主引用文献 | Northeast Structural Genomics Consortium Target OR151 To be Published
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4KAC
| X-Ray Structure of the complex HaloTag2 with HALTS. Northeast Structural Genomics Consortium (NESG) Target OR150. | 分子名称: | 2-{2-[2-(2-{2-[2-(2-ETHOXY-ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)-ETHOXY]-ETHOXY}-ETHANOL, AMMONIUM ION, Haloalkane dehalogenase, ... | 著者 | Kuzin, A, Lew, S, Neklesa, T.K, Noblin, D, Seetharaman, J, Maglaqui, M, Xiao, R, Kohan, E, Wang, H, Everett, J.K, Acton, T.B, Kornhaber, G, Montelione, G.T, Crews, C.M, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG) | 登録日 | 2013-04-22 | 公開日 | 2013-06-05 | 最終更新日 | 2023-12-06 | 実験手法 | X-RAY DIFFRACTION (2.223 Å) | 主引用文献 | Northeast Structural Genomics Consortium Target OR150 To be Published
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3W9U
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4K2A
| Crystal structure of haloalkane dehalogenase DbeA from Bradyrhizobium elkani USDA94 | 分子名称: | ACETATE ION, CHLORIDE ION, Haloalkane dehalogenase | 著者 | Prudnikova, T, Chaloupkova, R, Rezacova, P, Mozga, T, Koudelakova, T, Sato, Y, Kuty, M, Nagata, Y, Damborsky, J, Kuta Smatanova, I, Structure 2 Function Project (S2F) | 登録日 | 2013-04-08 | 公開日 | 2014-06-25 | 最終更新日 | 2024-02-28 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Structural and functional analysis of a novel haloalkane dehalogenase with two halide-binding sites. Acta Crystallogr.,Sect.D, 70, 2014
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4JNC
| Soluble Epoxide Hydrolase complexed with a carboxamide inhibitor | 分子名称: | 1-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]-N-[2-(trifluoromethyl)benzyl]piperidine-4-carboxamide, Bifunctional epoxide hydrolase 2 | 著者 | Shewchuk, L.M. | 登録日 | 2013-03-15 | 公開日 | 2013-06-05 | 最終更新日 | 2023-09-20 | 実験手法 | X-RAY DIFFRACTION (1.96 Å) | 主引用文献 | Discovery of 1-(1,3,5-triazin-2-yl)piperidine-4-carboxamides as inhibitors of soluble epoxide hydrolase. Bioorg.Med.Chem.Lett., 23, 2013
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4J03
| Crystal structure of human soluble epoxide hydrolase complexed with fulvestrant | 分子名称: | (7beta,9beta,13alpha,17beta)-7-{9-[(R)-(4,4,5,5,5-pentafluoropentyl)sulfinyl]nonyl}estra-1(10),2,4-triene-3,17-diol, Bifunctional epoxide hydrolase 2, MAGNESIUM ION, ... | 著者 | Morisseau, C, Pakhomova, S, Hwang, S.H, Newcomer, M.E, Hammock, B.D. | 登録日 | 2013-01-30 | 公開日 | 2013-06-05 | 最終更新日 | 2023-09-20 | 実験手法 | X-RAY DIFFRACTION (2.92 Å) | 主引用文献 | Inhibition of soluble epoxide hydrolase by fulvestrant and sulfoxides. Bioorg.Med.Chem.Lett., 23, 2013
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4IVJ
| Structure of a 16 nm protein cage designed by fusing symmetric oligomeric domains, triple mutant, I222 form | 分子名称: | Non-haem bromoperoxidase BPO-A2, Matrix protein 1 | 著者 | Lai, Y.-T, Sawaya, M.R, Yeates, T.O. | 登録日 | 2013-01-23 | 公開日 | 2013-07-24 | 最終更新日 | 2023-09-20 | 実験手法 | X-RAY DIFFRACTION (7.351 Å) | 主引用文献 | Structure and flexibility of nanoscale protein cages designed by symmetric self-assembly. J.Am.Chem.Soc., 135, 2013
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4ITV
| Structure of a 16 nm protein cage designed by fusing symmetric oligomeric domains, triple mutant, P212121 form | 分子名称: | Non-haem bromoperoxidase BPO-A2, Matrix protein 1 | 著者 | Lai, Y.-T, Sawaya, M.R, Yeates, T.O. | 登録日 | 2013-01-18 | 公開日 | 2013-07-24 | 最終更新日 | 2023-09-20 | 実験手法 | X-RAY DIFFRACTION (3.598 Å) | 主引用文献 | Structure and flexibility of nanoscale protein cages designed by symmetric self-assembly. J.Am.Chem.Soc., 135, 2013
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