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Trajectories dataTrajectories of WW domain
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2020-04-23
相关数据集
Structural Determinants of Phosphopeptide Binding to the N‑Terminal Src Homology 2 Domain of the SHP2 Phosphatase
SH2 domain-containing tyrosine phosphatase 2 (SHP2), encoded by PTPN11, plays a fundamental role in the modulation of several signaling pathways. Germline and somatic mutations in PTPN11 are associate
NIAID Data Ecosystem40
NleC and Protealysin Pulling SImulations
Biased MD simulations of proteins NleC (4Q3J on the protein data bank, PDB), and protealysin (2VQX on the PDB). This data corresponds to the publication "A Type III secretion effector evolved to be m
Zenodo2026-06-08 更新00
Mechanism of Hormone Peptide Activation of a GPCR: Angiotensin II Activated State of AT 1 R Initiated by van der Waals Attraction
We present a succession of structural changes involved in hormone peptide activation of a prototypical GPCR. Microsecond molecular dynamics simulation generated conformational ensembles reveal propaga
NIAID Data Ecosystem20
H118Y_VUS
A total of 213 PTEN missense variants comprising of 147 VUS, 54 ClinVar Pathogenic and 12 Benign variants were slected for classification utilizing the MD simulations study.
NIAID Data Ecosystem00
