1ONY

Oxalyl-Aryl-Amino Benzoic Acid inhibitors of PTP1B, compound 17

1ONY の概要

関連するPDBエントリー1NL9 1NNY 1No6 1NZ7 1onz
分子名称Protein-tyrosine phosphatase, non-receptor type 1, 2-{[2-(2-CARBAMOYL-VINYL)-4-(2-METHANESULFONYLAMINO-2-PENTYLCARBAMOYL-ETHYL)-PHENYL]-OXALYL-AMINO}-BENZOIC ACID (3 entities in total)
機能のキーワードprotein tyrosine phosphatase, oxalyl-aryl-amino benzoic acid inhibitor, hydrolase
由来する生物種Homo sapiens (human)
細胞内の位置Endoplasmic reticulum membrane ; Peripheral membrane protein ; Cytoplasmic side  P18031
ポリマー鎖数1
分子量合計37954.27
構造登録者
主引用文献
Liu, G.,Szczepankiewicz, B.G.,Pei, Z.,Janowich, D.A.,Xin, Z.,Hadjuk, P.J.,Abad-Zapatero, C.,Liang, H.,Hutchins, C.W.,Fesik, S.W.,Ballaron, S.J.,Stashko, M.A.,Lubben, T.,Mika, A.K.,Zinker, B.A.,Trevillyan, J.M.,Jirousek, M.R.
Discovery and Structure-Activity Relationship of Oxalylarylaminobenzoic Acids as Inhibitors of Protein Tyrosine Phosphatase 1B
J.Med.Chem., 46:2093-2103, 2003
PubMed: 12747781 (主引用文献が同じPDBエントリー)
DOI: 10.1021/jm0205696
MImport into Mendeley
実験手法
X-RAY DIFFRACTION (2.15 Å)
NMR情報
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構造検証レポート

ClashscoreRamachandran outliersSidechain outliers90.7%3.1%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
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他の静止画像(非対称単位)

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