タイトル | Structural Basis for Targeting the Folded P-Loop Conformation of c-MET. |
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ジャーナル・号・ページ | Acs Med. Chem. Lett., Vol. 12, Page 162-167, Year 2021 |
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掲載日 | 2020年12月1日 (構造データの登録日) |
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著者 | Collie, G.W. / Michaelides, I.N. / Embrey, K. / Stubbs, C.J. / Borjesson, U. / Dale, I.L. / Snijder, A. / Barlind, L. / Song, K. / Khurana, P. ...Collie, G.W. / Michaelides, I.N. / Embrey, K. / Stubbs, C.J. / Borjesson, U. / Dale, I.L. / Snijder, A. / Barlind, L. / Song, K. / Khurana, P. / Phillips, C. / Storer, R.I. |
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リンク | Acs Med. Chem. Lett. / PubMed:33488978 |
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手法 | X線回折 |
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解像度 | 1.75 - 2.23 Å |
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構造データ | PDB-7b3q: Crystal structure of c-MET bound by compound 1 手法: X-RAY DIFFRACTION / 解像度: 1.75 Å PDB-7b3t: Crystal structure of c-MET bound by compound 2 手法: X-RAY DIFFRACTION / 解像度: 2.23 Å PDB-7b3v: Crystal structure of c-MET bound by compound 3 手法: X-RAY DIFFRACTION / 解像度: 1.93 Å PDB-7b3w: Crystal structure of c-MET bound by compound 4 手法: X-RAY DIFFRACTION / 解像度: 2.02 Å PDB-7b3z: Crystal structure of c-MET bound by compound 5 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-7b40: Crystal structure of c-MET bound by compound 6 手法: X-RAY DIFFRACTION / 解像度: 1.76 Å PDB-7b41: Crystal structure of c-MET bound by compound 7 手法: X-RAY DIFFRACTION / 解像度: 1.97 Å PDB-7b42: Crystal structure of c-MET bound by compound 8 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-7b43: Crystal structure of c-MET bound by compound 9 手法: X-RAY DIFFRACTION / 解像度: 1.87 Å PDB-7b44: Crystal structure of c-MET bound by compound S1 手法: X-RAY DIFFRACTION / 解像度: 1.76 Å |
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化合物 | ChemComp-SVK: 3-(phenylmethyl)-1~{H}-pyrrolo[2,3-b]pyridine
ChemComp-SWB: 3-(3-methyl-1~{H}-pyrrolo[2,3-b]pyridin-5-yl)-1~{H}-pyrrolo[3,4-b]pyrrol-6-one
ChemComp-SVH: 3-(6-fluoranyl-1~{H}-indazol-4-yl)-4,5-dihydro-1~{H}-pyrrolo[3,4-b]pyrrol-6-one
ChemComp-SV8: 3-[3-(phenylmethyl)-1~{H}-pyrrolo[2,3-b]pyridin-5-yl]-4,5-dihydro-1~{H}-pyrrolo[3,4-b]pyrrol-6-one
ChemComp-SWN: 3-(phenylmethyl)-5-(1-piperidin-4-ylpyrazol-4-yl)-1~{H}-pyrrolo[2,3-b]pyridine
ChemComp-SWK: 3-[(2-fluorophenyl)methyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1~{H}-pyrrolo[2,3-b]pyridine
ChemComp-SW8: 3-[(3-fluorophenyl)methyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1~{H}-pyrrolo[2,3-b]pyridine
ChemComp-SW5: 3-[(4-fluorophenyl)methyl]-5-(1-piperidin-4-ylpyrazol-4-yl)-1~{H}-pyrrolo[2,3-b]pyridine
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由来 | homo sapiens (ヒト)
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キーワード | TRANSFERASE / c-met / kinase / folded P-loop / inhibitor |
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