Download Table S2.

Supporting Table S2
Resonance assignment used for deconvolution of NMR spectra of macrophage
suspensions. Lineshape abbreviations: singlet (s), doublet (d), multiplet (m), broad peak
treated as singlet (b), multiplet treated as broad singlet (m / b).
Chemical
shift [ppm]
0.89
0.87 & 0.93
0.90 – 1.05
1.21
1.28
1.32
1.39
1.47
1.58
1.68
1.76
1.91
2.03
1.93
1.95 – 2.40
2.24
2.06 & 2.15
2.54
2.79
Compound name
Line shape
Abbreviation
Remarks
Mobile lipid methyl groups
Mobile protein branched
chain amino acid residues
Branched-chain amino acids
Mobile protein threonine
residues
Mobile lipid methylene
groups
Lactate
Mobile protein alanine
residues
Alanine
Mobile lipid methylene
groups
Mobile protein leucine,
lysine and arginine residues
Dimethyl-silapentanesulfonate
Acetate
Mobile lipid methylene
groups
Mobile protein glutamine,
glutamate and proline
residues
Glutamine, glutamate,
proline, glutathione
Mobile lipid methylene
groups
Mobile protein glutamine,
glutamate and proline
residues
Glutathione
Mobile lipid methylene
groups
b
b&b
-CH3 (ML1)
M1 or MP1
Terminal group of fatty acid chains in mobile lipids
m
b
BCAA
M2 or MP2
Valine, leucine and isoleucine
Minor contributions of mobile protein isoleucine residues
b
-CH2-CH2-CH2- (ML2)
Methylene groups neighbored by methylene groups within fatty
acid chains
d
b
lac
M3 or MP3
d
b
ala
-CO-CH2-CH2- (ML3)
b
M4 or MP4
m/b
DSS
Added chemical shift standard
s
b
ace
=CH-CH2-CH2- (ML4)
Impurity
Methylene groups next to one (!) double bonded methine pair
within unsaturated fatty acid chains
b
M5 or MP5
m/b
glx
b
-CO-CH2- (ML5)
b&b
M6 or MP6
m/b
b
GSH
=CH-CH2-CH= (ML6)
Minor contributions of mobile protein lysine and isoleucine
residues
Second methylene group of fatty acid chains (near carboxyl
group)
First methylene group of fatty acid chains (next to carboxyl group)
Bis-allylic methylene groups (surrounded by double bonded
methine pairs) within poly-unsaturated fatty acid chains