Fig. 5: NOESY spectra of non-deuterated 80 kDa MSG. | Nature Communications

Fig. 5: NOESY spectra of non-deuterated 80 kDa MSG.

From: Solution-state methyl NMR spectroscopy of large non-deuterated proteins enabled by deep neural networks

Fig. 5

Two-dimensional planes from the 3D 13C-13C-1H NOESY spectrum for a I5-13Cδ1 and A14-13Cβ. b I327-13Cδ1 and A321-13Cβ. c A63-13Cβ and L88-13Cδ1. d M415-13Cε and L375-13Cδ1. e Methyl groups of isoleucine, leucine, valine, methionine, alanine, and threonine showing NOE cross-peaks in the 3D 13C-13C-1H NOESY spectra are highlighted as cyan spheres on a cartoon representation of Malate Synthase G (MSG) structure (PDB entry:1D8C). f Normalised NOE cross-peak volumes (cross-peak volume/diagonal-peak volume) versus interproton distances. Grey circles represent the normalised NOE cross-peak volumes obtained for individual NOE cross-peaks, whereas blue circles represent the average of normalised NOE cross-peaks volume over interproton-distance intervals of 0.2 Å, i.e. (Sum of normalised NOE cross-peak volumes) / (Number of cross-peaks), within each interproton-distance interval of 0.2 Å. The blue line represents the fitted curve of NOE cross-peaks volume (V ) and interproton distance (r) using the standard equation V = C/r6, where C is a constant.

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