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Functionally Important Residues from Graph Analysis of Co-evolved Dynamical Couplings

NIAID Data Ecosystem2026-05-02 收录

蛋白质功能残基

分子动力学模拟

数据链接：

https://zenodo.org/record/13693143 数据链接链接失效反馈

官方服务：

资源简介：

This dataset contains input files and trajectories for class A β-lactamase SHV-1.

应用场景：

创建时间：

2024-10-02

分子动力学模拟

血红蛋白功能

Nitrophorin 4 (NP4) is a heme protein that reversibly binds nitric oxide (NO), with release rates modulated by pH change. High-resolution structures of NP4 revealed that pH changes and NO binding indu

NIAID Data Ecosystem60

Pub1-PRE experimental data.zip

蛋白质结构解析

分子动力学模拟

Structure Ensemble of the First Two RNA Recognition Motif Domains of a Poly(U) Binding Protein from Paramagnetic Relaxation Enhancement and Molecular Simulation Guan

Figshare2016-04-21 更新10

ParM from plasmid R1 APO form

ParM蛋白结构

分子动力学模拟

ParM from plasmid R1 APO form

NIAID Data Ecosystem00

Structural Determinants of Phosphopeptide Binding to the N‑Terminal Src Homology 2 Domain of the SHP2 Phosphatase

蛋白质-磷酸肽结合

分子动力学模拟

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

Spike-MD Data for "CryoBench: Diverse and challenging datasets for the heterogeneity problem in cryo-EM"

冷冻电镜异质性

分子动力学模拟

A synthetic cryo-EM dataset with heterogeneity from a molecular dynamics simulation and ground truth atomic models, poses, labels, mask, and consensus volume: Spike-MD: 100k particle images (256x25

NIAID Data Ecosystem10

Functionally Important Residues from Graph Analysis of Co-evolved Dynamical Couplings

资源简介：

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