2AYP

Crystal Structure of CHK1 with an Indol Inhibitor

2AYP の概要

分子名称Serine/threonine-protein kinase Chk1, (3Z)-6-(4-HYDROXY-3-METHOXYPHENYL)-3-(1H-PYRROL-2-YLMETHYLENE)-1,3-DIHYDRO-2H-INDOL-2-ONE (2 entities in total)
機能のキーワードprotein-inhibitor complex, transferase
由来する生物種Homo sapiens (human)
細胞内の位置Nucleus O14757
ポリマー鎖数1
分子量合計31403.11
構造登録者
Lin, N.-H.,Xia, P.,Kovar, P.,Chen, Z.,Zhang, H.,Rosenberg, S.H.,Sham, H.L. (登録日: 2005-09-07, 公開日: 2006-09-12, 最終更新日: 2011-07-13)
主引用文献
Lin, N.-H.,Xia, P.,Kovar, P.,Park, C.,Chen, Z.,Zhang, H.,Rosenberg, S.H.,Sham, H.L.
Synthesis and biological evaluation of 3-ethylidene-1,3-dihydro-indol-2-ones as novel checkpoint 1 inhibitors
Bioorg.Med.Chem.Lett., 16:421-426, 2006
PubMed: 16242328 (主引用文献が同じPDBエントリー)
DOI: 10.1016/j.bmcl.2005.09.064
MImport into Mendeley
実験手法
X-RAY DIFFRACTION (2.9 Å)
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構造検証レポート

ClashscoreRamachandran outliersSidechain outliers342.3%6.8%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
検証レポート(詳細版)をダウンロード

他の静止画像(非対称単位)

Molmil generated image of 2ayp
回転なし
Molmil generated image of 2ayp
x軸(左右方向)周りに90°回転
Molmil generated image of 2ayp
y軸(上下方向)周りに90°回転