title: Synthesis of three enantiomeric pairs of scyllo-inositol phosphate and molecular interactions between all possible regioisomers of scyllo-inositol phosphate and inositol 1,4,5-trisphosphate 3-kinase.
abstract: scyllo-Inositol phosphates, which are among the stereoisomers of myo-inositol phosphate, can have 15 possible regioisomers including three enantiomeric pairs: scyllo-I(1,2)P(2), scyllo-I(1,2,4)P(3), scyllo-I(1,2,3,4)P(4). We herein describe the facile synthetic routes to the three enantiomeric pairs of scyllo-inositol phosphate and the molecular interactions between 15 regioisomers of scyllo-inositol phosphate and inositol 1,4,5-trisphosphate 3-kinase. Geometry of the enzyme binding site is discussed.
authors.affiliation: Department of Chemistry, Division of Molecular and Life Sciences, Pohang University of Science & Technology, Pohang 790-784, South Korea.
authors.forename: Yong-Uk
authors.initials: YU
authors.lastname: Kwon
authors.forename: Jungkyun
authors.initials: J
authors.lastname: Im
authors.forename: Gildon
authors.initials: G
authors.lastname: Choi
authors.forename: Young-Soo
authors.initials: YS
authors.lastname: Kim
authors.forename: Kwan Yong
authors.initials: KY
authors.lastname: Choi
authors.forename: Sung-Kee
authors.initials: SK
authors.lastname: Chung
mesh_terms: D000818:Animals; D001665:Binding Sites; D004791:Enzyme Inhibitors / Q000138:chemical synthesis / Q000494:pharmacology; D020128:Inhibitory Concentration 50; D007294:Inositol / Q000138:chemical synthesis / Q000494:pharmacology; D007295:Inositol Phosphates / Q000138:chemical synthesis* / Q000494:pharmacology; D009904:Optical Rotation; D017853:Phosphotransferases (Alcohol Group Acceptor) / Q000037:antagonists & inhibitors / Q000378:metabolism*; D011485:Protein Binding; D051381:Rats; D013237:Stereoisomerism; D013329:Structure-Activity Relationship
chemical_list: D004791:Enzyme Inhibitors; D007295:Inositol Phosphates; C009217:scyllitol; D007294:Inositol; D017853:Phosphotransferases (Alcohol Group Acceptor); C051038:Inositol 1,4,5-trisphosphate 3-kinase