PDB: 1335 件ウェブページステータス検索Chemie searchBIRD

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8DPO	Crystal structure of Neisseria gonorrhoeae carbonic anhydrase with Acetazolamide 分子名称: 5-ACETAMIDO-1,3,4-THIADIAZOLE-2-SULFONAMIDE, Carbonic anhydrase, SULFATE ION, ... 著者 Marapaka, A.K, Das, C, Flaherty, D.P, Yadav, R. 登録日 2022-07-15 公開日 2023-07-19 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2.6 Å) 主引用文献 Crystal structure of Neisseria gonorrhoeae carbonic anhydrase with Acetazolamide To Be Published
3DVB	X-ray crystal structure of mutant N62V human Carbonic Anhydrase II 分子名称: Carbonic anhydrase 2, ZINC ION 著者 Avvaru, B.S. 登録日 2008-07-18 公開日 2008-11-11 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Role of hydrophilic residues in proton transfer during catalysis by human carbonic anhydrase II. Biochemistry, 47, 2008
8EXG	Human Carbonic Anhydrase II bound N-(2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethyl)-4-sulfamoylbenzamide 分子名称: (4S)-5-amino-4-{1,3-dioxo-4-[(2-{2-[2-(4-sulfamoylbenzamido)ethoxy]ethoxy}ethyl)amino]-1,3-dihydro-2H-isoindol-2-yl}-5-oxopentanoic acid, Carbonic anhydrase 2, MERCURIBENZOIC ACID, ... 著者 Kohlbrand, A.J, O'Herin, C.B. 登録日 2022-10-25 公開日 2023-02-22 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.99 Å) 主引用文献 Development of Human Carbonic Anhydrase II Heterobifunctional Degraders. J.Med.Chem., 2023
8EXC	Human Carbonic Anhydrase II bound tert-butyl (3-(4-(3-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)propoxy)butoxy)propyl)carbamate 分子名称: Carbonic anhydrase 2, MERCURIBENZOIC ACID, N-(3-{4-[3-({2-[(3R)-2,6-dioxopiperidin-3-yl]-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl}amino)propoxy]butoxy}propyl)-4-sulfamoylbenzamide, ... 著者 Kohlbrand, A.J, O'Herin, C.B. 登録日 2022-10-25 公開日 2023-02-22 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Development of Human Carbonic Anhydrase II Heterobifunctional Degraders. J.Med.Chem., 2023
8EMU	Human Carbonic Anhydrase II Heterobifunctional Degraders 分子名称: Carbonic anhydrase 2, MERCURIBENZOIC ACID, N-(2-methoxyethyl)-4-sulfamoylbenzamide, ... 著者 Kohlbrand, A.J, O'Herin, C.B. 登録日 2022-09-28 公開日 2023-02-15 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.13 Å) 主引用文献 Development of Human Carbonic Anhydrase II Heterobifunctional Degraders. J.Med.Chem., 66, 2023
8EYL	Human Carbonic Anhydrase II with Tert-butyl (2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethyl)carbamate 分子名称: 2-[[(2~{R})-1-azanyl-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]carbamoyl]-6-[2-[2-[(4-sulfamoylphenyl)carbonylamino]ethoxy]ethylamino]benzoic acid, Carbonic anhydrase 2, MERCURIBENZOIC ACID, ... 著者 Kohlbrand, A.J, O'Herin, C.B. 登録日 2022-10-27 公開日 2023-02-22 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (1.18 Å) 主引用文献 Development of Human Carbonic Anhydrase II Heterobifunctional Degraders. J.Med.Chem., 2023
3DVC	X-ray crystal structure of mutant N62T of human Carbonic Anhydrase II 分子名称: Carbonic anhydrase 2, ZINC ION 著者 Avvaru, B.S. 登録日 2008-07-18 公開日 2008-11-11 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Role of hydrophilic residues in proton transfer during catalysis by human carbonic anhydrase II. Biochemistry, 47, 2008
3DC3	Use of Carbonic Anhydrase II, IX Active-Site Mimic, for the Purpose of Screening Inhibitors for Possible Anti-Cancer Properties 分子名称: 5-ACETAMIDO-1,3,4-THIADIAZOLE-2-SULFONAMIDE, Carbonic anhydrase 2, ZINC ION 著者 Genis, C, Sippel, K.H, Case, N, Govindasamy, L, Agbandje-Mckenna, M, Mckenna, R. 登録日 2008-06-03 公開日 2009-03-03 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Design of a carbonic anhydrase IX active-site mimic to screen inhibitors for possible anticancer properties Biochemistry, 48, 2009
3DC9	Use of Carbonic Anhydrase II, IX Active-Site Mimic, for the Purpose of Screening Inhibitors for Possible Anti-Cancer Properties 分子名称: Carbonic anhydrase 2, ZINC ION 著者 Genis, C, Sippel, K.H, Case, N, Govindasamy, L, Agbandje-Mckenna, M, Mckenna, R. 登録日 2008-06-03 公開日 2009-03-03 最終更新日 2023-08-30 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Design of a carbonic anhydrase IX active-site mimic to screen inhibitors for possible anticancer properties Biochemistry, 48, 2009
8EM3	Carbonic Anhydrase II in complex with the diaryl urea molecule J2 分子名称: 4-[(3-methoxyphenyl)carbamamido]benzene-1-sulfonamide, Carbonic anhydrase 2, ZINC ION 著者 Combs, J, McKenna, R. 登録日 2022-09-26 公開日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.62 Å) 主引用文献 Prospective Diaryl urea: Prevent growth of breast cancer cells by inhibition and down-regulation of Carbonic Anhydrase IX. To Be Published
8FQX	Carbonic Anhydrase II in complex with the alkyl ureas 3g 分子名称: 4-hydroxy-3-({[(pyridin-4-yl)methyl]carbamoyl}amino)benzene-1-sulfonamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... 著者 Combs, J.E, McKenna, R. 登録日 2023-01-06 公開日 2023-02-01 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.496 Å) 主引用文献 New Insights into Conformationally Restricted Carbonic Anhydrase Inhibitors. Molecules, 28, 2023
8FQZ	Carbonic Anhydrase II in complex with the alkyl urea 3j 分子名称: 4-hydroxy-3-{[(4-hydroxybutyl)carbamoyl]amino}benzene-1-sulfonamide, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... 著者 Combs, J.C, McKenna, R. 登録日 2023-01-06 公開日 2023-02-01 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.467 Å) 主引用文献 New Insights into Conformationally Restricted Carbonic Anhydrase Inhibitors. Molecules, 28, 2023
8FR1	Carbonic Anhydrase IX in complex with the alkyl urea compound 3g 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, 4-hydroxy-3-({[(pyridin-4-yl)methyl]carbamoyl}amino)benzene-1-sulfonamide, Carbonic anhydrase 2, ... 著者 Combs, J.C, McKenna, R. 登録日 2023-01-06 公開日 2023-02-01 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 New Insights into Conformationally Restricted Carbonic Anhydrase Inhibitors. Molecules, 28, 2023
8FQY	Carbonic Anhydrase II in complex with the alkyl urea 3h 分子名称: 4-hydroxy-3-({[2-(pyridin-2-yl)ethyl]carbamoyl}amino)benzene-1-sulfonamide, Carbonic anhydrase 2, ZINC ION 著者 Combs, J.C, McKenna, R. 登録日 2023-01-06 公開日 2023-02-01 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.466 Å) 主引用文献 New Insights into Conformationally Restricted Carbonic Anhydrase Inhibitors. Molecules, 28, 2023
8FR4	Carbonic Anhydrase IX-mimic in complex with the alkyl urea compound 3j 分子名称: 4-hydroxy-3-{[(4-hydroxybutyl)carbamoyl]amino}benzene-1-sulfonamide, Carbonic anhydrase 2, GLYCEROL, ... 著者 Combs, J.E, McKenna, R. 登録日 2023-01-06 公開日 2023-02-01 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.123 Å) 主引用文献 New Insights into Conformationally Restricted Carbonic Anhydrase Inhibitors. Molecules, 28, 2023
8FR2	Carbonic Anhydrase IX-mimic in complex with the alkyl urea compound 3h 分子名称: 4-hydroxy-3-({[2-(pyridin-2-yl)ethyl]carbamoyl}amino)benzene-1-sulfonamide, Carbonic anhydrase 2, GLYCEROL, ... 著者 Combs, J.C, McKenna, R. 登録日 2023-01-06 公開日 2023-02-01 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.307 Å) 主引用文献 New Insights into Conformationally Restricted Carbonic Anhydrase Inhibitors. Molecules, 28, 2023
8FAU	Masking thiol reactivity with thioamide-based MBPs- carbonic anhydrase II complexed with 4-phenylthiazole-2(3H)-thione 分子名称: 4-phenyl-1,3-thiazole-2(3H)-thione, Carbonic anhydrase 2, SULFATE ION, ... 著者 Kohlbrand, A.J, Seo, H. 登録日 2022-11-28 公開日 2023-03-01 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.44 Å) 主引用文献 Masking thiol reactivity with thioamide, thiourea, and thiocarbamate-based MBPs. Chem.Commun.(Camb.), 59, 2023
8FAL	Masking thiol reactivity with thioamide-based MBPs- carbonic anhydrase II complexed with benzo[d]thiazole-2(3H)-thione 分子名称: 1,3-benzothiazole-2(3H)-thione, Carbonic anhydrase 2, DIMETHYL SULFOXIDE, ... 著者 Kohlbrand, A.J, Seo, H. 登録日 2022-11-28 公開日 2023-03-01 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (1.37 Å) 主引用文献 Masking thiol reactivity with thioamide, thiourea, and thiocarbamate-based MBPs. Chem.Commun.(Camb.), 59, 2023
3F7U	Crystal Structure of soluble domain of CA4 in complex with small molecule. 分子名称: Carbonic anhydrase 4, N-(3-methoxypropyl)-2-(phenylsulfanyl)-5-sulfamoylpyridine-3-carboxamide, ZINC ION 著者 Pauly, T.A, Ferre, R.A.A, Greasley, S.E, Paz, R. 登録日 2008-11-10 公開日 2009-09-22 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Thioether benzenesulfonamide inhibitors of carbonic anhydrases II and IV: structure-based drug design, synthesis, and biological evaluation. Bioorg.Med.Chem., 18, 2010
7Y2M	apo-Carbonic Anhydrase II soaked in 3NPA after UV at 140 K 分子名称: Carbonic anhydrase 2 著者 Kim, C.U, Kim, J.K. 登録日 2022-06-09 公開日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.25 Å) 主引用文献 Temperature series of human Carbonic Anhydrase II with photolysis of caged CO2 To Be Published
7Y2C	Zn-Carbonic Anhydrase II complexed with 3NPA after UV at 90 K 分子名称: 3-NITROTOLUENE, Carbonic anhydrase 2, ZINC ION 著者 Kim, C.U, Kim, J.K. 登録日 2022-06-09 公開日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.2 Å) 主引用文献 Temperature series of human Carbonic Anhydrase II with photolysis of caged CO2 To Be Published
7Y2E	Zn-Carbonic Anhydrase II complexed with 3NPA after UV at 120 K 分子名称: 3-NITROTOLUENE, Carbonic anhydrase 2, ZINC ION 著者 Kim, C.U, Kim, J.K. 登録日 2022-06-09 公開日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.2 Å) 主引用文献 Temperature series of human Carbonic Anhydrase II with photolysis of caged CO2 To Be Published
7Y2S	Ni-Carbonic Anhydrase II complexed with 3NPA after UV at 100 K 分子名称: 2-(3-NITROPHENYL)ACETIC ACID, Carbonic anhydrase 2, NICKEL (II) ION 著者 Kim, C.U, Kim, J.K. 登録日 2022-06-09 公開日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.2 Å) 主引用文献 Temperature series of human Carbonic Anhydrase II with photolysis of caged CO2 To Be Published
7Y2U	Ni-Carbonic Anhydrase II complexed with 3NPA after UV at 140 K 分子名称: 2-(3-NITROPHENYL)ACETIC ACID, Carbonic anhydrase 2, NICKEL (II) ION 著者 Kim, C.U, Kim, J.K. 登録日 2022-06-09 公開日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.2 Å) 主引用文献 Temperature series of human Carbonic Anhydrase II with photolysis of caged CO2 To Be Published
7Y2K	apo-Carbonic Anhydrase II soaked in 3NPA after UV at 90 K 分子名称: Carbonic anhydrase 2 著者 Kim, C.U, Kim, J.K. 登録日 2022-06-09 公開日 2023-12-20 実験手法 X-RAY DIFFRACTION (1.25 Å) 主引用文献 Temperature series of human Carbonic Anhydrase II with photolysis of caged CO2 To Be Published

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