Cargando…
Characterization of Ionizable Groups’ Environments in Proteins and Protein–Ligand Complexes through a Statistical Analysis of the Protein Data Bank
[Image: see text] We conduct a statistical analysis of the molecular environment of common ionizable functional groups in both protein–ligand complexes and inside proteins from the Protein Data Bank (PDB). In particular, we characterize the frequency, type, and density of the interacting atoms as we...
| Autores principales: | , , |
|---|---|
| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2017
|
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6645025/ https://www.ncbi.nlm.nih.gov/pubmed/31457307 http://dx.doi.org/10.1021/acsomega.7b00739 |