Prediction of interface between regions of varying degrees of order or disorderness in intrinsically disordered proteins from dihedral angles.

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Tác giả: Venkata Satish Kumar Mattaparthi, Babli Sharma

Ngôn ngữ: eng

Ký hiệu phân loại: 967.61044 *Uganda and Kenya

Thông tin xuất bản: England : Journal of biomolecular structure & dynamics , 2025

Mô tả vật lý:

Bộ sưu tập: NCBI

ID: 173190

Intrinsically disordered proteins (IDPs) are proteins that do not form uniquely defined three-dimensional (3-D) structures. Experimental research on IDPs is difficult since they go against the traditional protein structure-function paradigm. Although there are several predictors of disorder based on amino acid sequences, but very limited based on the 3-D structures of proteins. Dihedral angles have a significant role in predicting protein structure because they establish a protein's backbone, which, coupled with its side chain, establishes its overall shape. Here, we have carried out atomistic Molecular Dynamics (MD) simulations on four different proteins: one ordered protein (Monellin), two partially disordered proteins (p53-TAD and Amyloid beta (Aβ
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