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Methods of identifying insect-specific spider toxin mimics

机译:鉴定昆虫特异性蜘蛛毒素模拟物的方法

摘要

Disclosed herein are methods of identifying a candidate molecule that mimics at least a portion of the three-dimensional structure of a rU-ACTX-Hv1a insecticidal toxin, the method comprising providing a molecular model made from the atomic co-ordinates for the rU-ACTX-Hv1a insecticidal toxin as disclosed herein, using the molecular model to identify a candidate molecule that mimics the three-dimensional structure of the rU-ACTX-Hv1a insecticidal toxin; and providing the candidate molecule that is identified. The method optionally comprises employing a molecular model identifying the pharmacophoric residues of U-ACTX as Q8, P9, N28, and V34.
机译:本文公开了鉴定模仿rU-ACTX-Hv1a杀虫毒素的三维结构的至少一部分的候选分子的方法,该方法包括提供由rU-ACTX的原子坐标制成的分子模型。如本文所公开的-Hv1a杀虫毒素,使用分子模型来鉴定模拟rU-ACTX-Hv1a杀虫毒素的三维结构的候选分子;并提供已识别的候选分子。该方法可选地包括采用分子模型,该分子模型将U-ACTX的药效学残基鉴定为Q 8 ,P 9 ,N 28 和V < Sup> 34

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