| タイトル | Screening a knowledge-based library of low molecular weight compounds against the proline biosynthetic enzyme 1-pyrroline-5-carboxylate 1 (PYCR1). |
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| ジャーナル・号・ページ | Protein Sci., Vol. 33, Page e5072-e5072, Year 2024 |
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| 掲載日 | 2023年7月2日 (構造データの登録日) |
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著者 | Meeks, K.R. / Bogner, A.N. / Tanner, J.J. |
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リンク | Protein Sci. / PubMed:39133178 |
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| 手法 | X線回折 |
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| 解像度 | 1.42 - 2.3 Å |
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| 構造データ | PDB-8td2: Structure of PYCR1 complexed with NADH and cyclobutane-1,1-dicarboxylic acid 手法: X-RAY DIFFRACTION / 解像度: 1.65 Å PDB-8td3: Structure of PYCR1 complexed with NADH and (S)-Tetrahydro-2H-pyran-2-carboxylic acid 手法: X-RAY DIFFRACTION / 解像度: 1.67 Å PDB-8td4: Structure of PYCR1 complexed with NADH and 1,3-Dithiolane-2-carboxylic acid 手法: X-RAY DIFFRACTION / 解像度: 1.76 Å PDB-8td5: Structure of PYCR1 complexed with NADH and Tetrahydrothiophene-2-carboxylic acid 手法: X-RAY DIFFRACTION / 解像度: 1.81 Å PDB-8td6: Structure of PYCR1 complexed with NADH and 2-(Methylthio)acetic acid 手法: X-RAY DIFFRACTION / 解像度: 2.08 Å PDB-8td7: Structure of PYCR1 complexed with 2S-hydroxy-3-methylbutyric acid 手法: X-RAY DIFFRACTION / 解像度: 1.61 Å PDB-8td8: Structure of PYCR1 complexed with NADH and 2S-Hydroxy-3,3-dimethylbutyric acid 手法: X-RAY DIFFRACTION / 解像度: 1.71 Å PDB-8td9: Structure of PYCR1 complexed with NADH and L-pipecolic acid 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-8tdb: Structure of PYCR1 complexed with NADH and 1-hydroxyethane-1-sulfonate 手法: X-RAY DIFFRACTION / 解像度: 2.3 Å PDB-8tdc: Structure of PYCR1 complexed with NADH and 1,3-dithiane-2-carboxylic acid 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-8tdd: Structure of PYCR1 complexed with NADH and 2-(furan-2-yl)acetic acid 手法: X-RAY DIFFRACTION / 解像度: 1.91 Å PDB-8vre: Structure of PYCR1 complexed with NADH and N-formyl-L-proline 手法: X-RAY DIFFRACTION / 解像度: 1.83 Å PDB-8w0k: Minimal PutA proline dehydrogenase domain (design #2) complexed with 1-hydroxyethane-1-sulfonate 手法: X-RAY DIFFRACTION / 解像度: 1.42 Å |
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| 化合物 | ChemComp-NAI: 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE
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| 由来 | homo sapiens (ヒト) sinorhizobium meliloti sm11 (根粒菌)
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キーワード | OXIDOREDUCTASE/INHIBITOR / AMINO-ACID BIOSYNTHESIS / OXIDOREDUCTASE / PROLINE BIOSYNTHESIS / OXIDOREDUCTASE-INHIBITOR complex / BETA/ALPHA BARREL / FLAVOENZYME / PROLINE CATABOLISM |
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