タイトル | Synthetic Inositol Phosphate Analogs Reveal that PPIP5K2 Has a Surface-Mounted Substrate Capture Site that Is a Target for Drug Discovery. |
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ジャーナル・号・ページ | Chem. Biol., Vol. 21, Page 689-699, Year 2014 |
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掲載日 | 2013年12月12日 (構造データの登録日) |
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著者 | Wang, H. / Godage, H.Y. / Riley, A.M. / Weaver, J.D. / Shears, S.B. / Potter, B.V. |
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リンク | Chem. Biol. / PubMed:24768307 |
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手法 | X線回折 |
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解像度 | 1.75 - 2 Å |
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構造データ | PDB-4nzm: Crystal structure of the catalytic domain of PPIP5K2 in complex with AMPPNP and 5-PA-InsP5 手法: X-RAY DIFFRACTION / 解像度: 2 Å PDB-4nzn: Crystal structure of the catalytic domain of PPIP5K2 in complex with AMPPNP and 2-O-BN-5-PA-INSP4 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-4nzo: Crystal structure of the catalytic domain of PPIP5K2 in complex with AMPPNP and 2,5-DI-O-BN-INSP4 手法: X-RAY DIFFRACTION / 解像度: 1.9 Å |
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化合物 | ChemComp-ANP: PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER / AMP-PNP / AMP-PNP, エネルギー貯蔵分子類似体*YM
ChemComp-0EJ: (2-oxo-2-{[(1s,2R,3S,4s,5R,6S)-2,3,4,5,6-pentakis(phosphonooxy)cyclohexyl]oxy}ethyl)phosphonic acid / 5-O-(ホスホノアセチル)-D-myo-イノシト-ル1,2,3,4,6-ペンタりん酸
ChemComp-2OU: (2-{[(1s,2R,3R,4r,5S,6S)-4-(benzyloxy)-2,3,5,6-tetrakis(phosphonooxy)cyclohexyl]oxy}-2-oxoethyl)phosphonic acid / 2-O-ベンジル-5-O-(ホスホノアセチル)-D-myo-イノシト-ル1,3,4,6-テトラりん酸
ChemComp-2OV: (1R,2R,3r,4S,5S,6s)-3,6-bis(benzyloxy)cyclohexane-1,2,4,5-tetrayl tetrakis[dihydrogen (phosphate)]
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由来 | - homo sapiens (ヒト)
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キーワード | TRANSFERASE/TRANSFERASE INHIBITOR / ATP-grasp Fold / Inositol Pyrophosphate Kinase / drug discovery / kinase / enzymology / inositol pyrophosphates / TRANSFERASE-TRANSFERASE INHIBITOR complex |
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