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. 2004 Mar;72(3):1402–1408. doi: 10.1128/IAI.72.3.1402-1408.2004

TABLE 5.

1H NMR chemical shifts for desferri form of fraction 4 at 293 K in DMSO-d6 confirm its identity as desferriferricrocin

Structural group Signal(s) at the following residuea:
Glycine (1) Serine (2) Glycine (3) N5-Acetyl-N5-hydroxyl-l-ornithine
4 5 6
NH 8.54 8.08 8.35 8.08 7.91 7.84
αCH 3.90, 3.41 4.19 3.77, 3.69 3.97 4.17 4.00
βCH 3.66, 3.55 1.69, 1.56 1.67, 1.57 1.62, 1.49
δCH 1.50, 1.50 1.52, 1.52 1.53, 1.43
γCH 3.45, 3.45 3.41, 3.49 3.44, 3.44
CH3 1.96 1.96 1.93
OH 3.50 9.72b
a

Numbers refer to the order in which residues occur in the ferricrocin molecule.

b

Broad NMR signal centered at 9.72 ppm and compatible with ornithine OH.