5QA4
| OXA-48 IN COMPLEX WITH COMPOUND 3a | 分子名称: | 1,2-ETHANEDIOL, 3-(2-methylphenyl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.95 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAO
| OXA-48 IN COMPLEX WITH COMPOUND 19b | 分子名称: | 1,2-ETHANEDIOL, 3-[4-(methylsulfonylaminomethyl)phenyl]benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QB0
| OXA-48 IN COMPLEX WITH COMPOUND 35 | 分子名称: | 1,2-ETHANEDIOL, 3-pyridin-2-ylbenzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.95 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAB
| OXA-48 IN COMPLEX WITH COMPOUND 6b | 分子名称: | 1,2-ETHANEDIOL, 3-(3-methoxyphenyl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (2.15 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAN
| OXA-48 IN COMPLEX WITH COMPOUND 19a | 分子名称: | 3-[3-(methylsulfonylaminomethyl)phenyl]benzoic acid, Beta-lactamase, CHLORIDE ION | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QB2
| OXA-48 IN COMPLEX WITH COMPOUND 38 | 分子名称: | 1,2-ETHANEDIOL, 3-quinolin-6-yl-5-quinolin-7-yl-benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.75 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAH
| OXA-48 IN COMPLEX WITH COMPOUND 9b | 分子名称: | 1,2-ETHANEDIOL, 3-(3-methoxycarbonylphenyl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.95 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAZ
| OXA-48 IN COMPLEX WITH COMPOUND 34 | 分子名称: | 1,2-ETHANEDIOL, 3-(1~{H}-indol-5-yl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QA6
| OXA-48 IN COMPLEX WITH COMPOUND 4a | 分子名称: | 1,2-ETHANEDIOL, 3-(2-hydroxyphenyl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.95 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAS
| OXA-48 IN COMPLEX WITH COMPOUND 23b | 分子名称: | 1,2-ETHANEDIOL, 3-[4-(2-acetamidoethyl)phenyl]benzoic acid, Beta-lactamase | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.9 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAJ
| OXA-48 IN COMPLEX WITH COMPOUND 13 | 分子名称: | 1,2-ETHANEDIOL, 3-(4-aminophenyl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (2 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAY
| OXA-48 IN COMPLEX WITH COMPOUND 32 | 分子名称: | 1,2-ETHANEDIOL, 3-(1-methylpyrrol-2-yl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.7 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QA7
| OXA-48 IN COMPLEX WITH COMPOUND 4b | 分子名称: | 1,2-ETHANEDIOL, 3-(3-hydroxyphenyl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.82 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAP
| OXA-48 IN COMPLEX WITH COMPOUND 21a | 分子名称: | 1,2-ETHANEDIOL, 3-(3-acetamidophenyl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (1.79 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAF
| OXA-48 IN COMPLEX WITH COMPOUND 8c | 分子名称: | 1,2-ETHANEDIOL, 3-(4-fluorophenyl)benzoic acid, Beta-lactamase, ... | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (2.15 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5QAR
| OXA-48 IN COMPLEX WITH COMPOUND 23a | 分子名称: | 3-[3-(2-acetamidoethyl)phenyl]benzoic acid, Beta-lactamase, CHLORIDE ION | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-11 | 公開日 | 2018-01-10 | 最終更新日 | 2023-11-15 | 実験手法 | X-RAY DIFFRACTION (2.1 Å) | 主引用文献 | A focused fragment library targeting the antibiotic resistance enzyme - Oxacillinase-48: Synthesis, structural evaluation and inhibitor design. Eur J Med Chem, 145, 2018
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5WI3
| Structure of Acinetobacter baumannii carbapenemase OXA-239 K82D bound to cefotaxime | 分子名称: | CEFOTAXIME, C3' cleaved, open, ... | 著者 | Harper, T.M, June, C.M, Powers, R.A, Leonard, D.A. | 登録日 | 2017-07-18 | 公開日 | 2017-12-27 | 最終更新日 | 2023-10-04 | 実験手法 | X-RAY DIFFRACTION (1.81 Å) | 主引用文献 | Multiple substitutions lead to increased loop flexibility and expanded specificity in Acinetobacter baumannii carbapenemase OXA-239. Biochem. J., 475, 2018
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5WIB
| Structure of Acinetobacter baumannii carbapenemase OXA-239 K82D bound to imipenem | 分子名称: | Imipenem, OXA-239 | 著者 | Harper, T.M, June, C.M, Powers, R.A, Leonard, D.A. | 登録日 | 2017-07-19 | 公開日 | 2017-12-27 | 最終更新日 | 2023-10-04 | 実験手法 | X-RAY DIFFRACTION (1.87 Å) | 主引用文献 | Multiple substitutions lead to increased loop flexibility and expanded specificity in Acinetobacter baumannii carbapenemase OXA-239. Biochem. J., 475, 2018
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5WI7
| Structure of Acinetobacter baumannii carbapenemase OXA-239 K82D bound to doripenem | 分子名称: | (4R,5S)-5-[(2S,3R)-3-hydroxy-1-oxobutan-2-yl]-4-methyl-3-({(3S,5S)-5-[(sulfamoylamino)methyl]pyrrolidin-3-yl}sulfanyl)-4,5-dihydro-1H-pyrrole-2-carboxylic acid, OXA-239 | 著者 | Harper, T.M, June, C.M, Powers, R.A, Leonard, D.A. | 登録日 | 2017-07-18 | 公開日 | 2017-12-27 | 最終更新日 | 2023-10-04 | 実験手法 | X-RAY DIFFRACTION (1.861 Å) | 主引用文献 | Multiple substitutions lead to increased loop flexibility and expanded specificity in Acinetobacter baumannii carbapenemase OXA-239. Biochem. J., 475, 2018
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5ODZ
| CRYSTAL STRUCTURE OF THE BETA-LACTAMASE OXA-163 | 分子名称: | Beta-lactamase, CHLORIDE ION, MAGNESIUM ION, ... | 著者 | Lund, B.A, Carlsen, T.J.O, Leiros, H.K.S. | 登録日 | 2017-07-07 | 公開日 | 2017-10-18 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (2.07 Å) | 主引用文献 | Structure, activity and thermostability investigations of OXA-163, OXA-181 and OXA-245 using biochemical analysis, crystal structures and differential scanning calorimetry analysis. Acta Crystallogr F Struct Biol Commun, 73, 2017
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5LP5
| Complex between Penicillin-Binding Protein (PBP2) and MreC from Helicobacter pylori | 分子名称: | Penicillin-binding protein 2 (Pbp2), Rod shape-determining protein (MreC) | 著者 | Contreras-Martel, C, Martins, A, Ecobichon, C, Maragno, D.M, Mattei, P.J, El Ghachi, M, Hicham, S, Hardouin, P, Boneca, I.G, Dessen, A. | 登録日 | 2016-08-11 | 公開日 | 2017-08-23 | 最終更新日 | 2024-01-10 | 実験手法 | X-RAY DIFFRACTION (2.74 Å) | 主引用文献 | Molecular architecture of the PBP2-MreC core bacterial cell wall synthesis complex. Nat Commun, 8, 2017
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5LP4
| Penicillin-Binding Protein (PBP2) from Helicobacter pylori | 分子名称: | Penicillin-binding protein 2 (Pbp2), SULFATE ION | 著者 | Contreras-Martel, C, Martins, A, Ecobichon, C, Maragno, D.M, Mattei, P.J, El Ghachi, M, Boneca, I.G, Dessen, A. | 登録日 | 2016-08-11 | 公開日 | 2017-08-23 | 最終更新日 | 2024-01-10 | 実験手法 | X-RAY DIFFRACTION (3.03 Å) | 主引用文献 | Molecular architecture of the PBP2-MreC core bacterial cell wall synthesis complex. Nat Commun, 8, 2017
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5IY2
| Structure of apo OXA-143 carbapenemase | 分子名称: | Beta-lactamase OXA-143, GLYCEROL | 著者 | Smith, C.A, Vakulenko, S.B. | 登録日 | 2016-03-23 | 公開日 | 2017-08-09 | 最終更新日 | 2019-12-11 | 実験手法 | X-RAY DIFFRACTION (1.15 Å) | 主引用文献 | The role of conserved surface hydrophobic residues in the carbapenemase activity of the class D beta-lactamases. Acta Crystallogr D Struct Biol, 73, 2017
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5OE2
| CRYSTAL STRUCTURE OF THE BETA-LACTAMASE OXA-245 | 分子名称: | Beta-lactamase, CHLORIDE ION, SODIUM ION | 著者 | Lund, B.A, Leiros, H.K.S. | 登録日 | 2017-07-07 | 公開日 | 2017-08-02 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Structure, activity and thermostability investigations of OXA-163, OXA-181 and OXA-245 using biochemical analysis, crystal structures and differential scanning calorimetry analysis. Acta Crystallogr F Struct Biol Commun, 73, 2017
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5OE0
| CRYSTAL STRUCTURE OF THE BETA-LACTAMASE OXA-181 | 分子名称: | Beta-lactamase, CHLORIDE ION, SULFATE ION | 著者 | Lund, B.A, Carlsen, T.J.O, Leiros, H.K.S, Thomassen, A.M. | 登録日 | 2017-07-07 | 公開日 | 2017-08-02 | 最終更新日 | 2024-01-17 | 実験手法 | X-RAY DIFFRACTION (2.0500083 Å) | 主引用文献 | Structure, activity and thermostability investigations of OXA-163, OXA-181 and OXA-245 using biochemical analysis, crystal structures and differential scanning calorimetry analysis. Acta Crystallogr F Struct Biol Commun, 73, 2017
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