Docking of 4-O-acetylated sialoglycans onto mammalian sialic acid esterase (SIAE) by molecular dynamics
收藏NIAID Data Ecosystem2026-05-02 收录
下载链接：
https://data.mendeley.com/datasets/s6jxg2pr4r
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资源简介：
Trajectory files of 10 ns production MD runs to dock 4-O-acetylated sialoglycans, with different glycosidic linkages (a2-3, a2-6).
Files are named according to the substrate used for docking.
4-O23 corresponds to Neu5,9Ac2a2-3Galb1-4GlcNAca-OH
4-O26 corresponds to Neu5,9Ac2a2-6Galb1-4GlcNAca-OH
创建时间：
2024-10-01
