8RD6

the C-terminal domain of TonB protein from Salmonella enterica.

8RD6 の概要

• エントリーDOI: 10.2210/pdb8rd6/pdb
• NMR情報: BMRB: 34887
• 分子名称: Protein TonB (1 entity in total)
• 機能のキーワード: protein, tonb, transport protein
• 由来する生物種: Salmonella enterica
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 10054.52

構造登録者

Iwai, H.,Ciragan, A.,Oeemig, J.S. (登録日: 2023-12-07, 公開日: 2024-01-17)

主引用文献

Klukowski, P.,Damberger, F.F.,Allain, F.H.,Iwai, H.,Kadavath, H.,Ramelot, T.A.,Montelione, G.T.,Riek, R.,Guntert, P.
The 100-protein NMR spectra dataset: A resource for biomolecular NMR data analysis.
Sci Data, 11:30-30, 2024

PubMed Abstract: Multidimensional NMR spectra are the basis for studying proteins by NMR spectroscopy and crucial for the development and evaluation of methods for biomolecular NMR data analysis. Nevertheless, in contrast to derived data such as chemical shift assignments in the BMRB and protein structures in the PDB databases, this primary data is in general not publicly archived. To change this unsatisfactory situation, we present a standardized set of solution NMR data comprising 1329 2-4-dimensional NMR spectra and associated reference (chemical shift assignments, structures) and derived (peak lists, restraints for structure calculation, etc.) annotations. With the 100-protein NMR spectra dataset that was originally compiled for the development of the ARTINA deep learning-based spectra analysis method, 100 protein structures can be reproduced from their original experimental data. The 100-protein NMR spectra dataset is expected to help the development of computational methods for NMR spectroscopy, in particular machine learning approaches, and enable consistent and objective comparisons of these methods.

PubMed: 38177162
DOI: 10.1038/s41597-023-02879-5

実験手法

SOLUTION NMR