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. Author manuscript; available in PMC: 2012 Aug 1.
Published in final edited form as: Nucl Med Biol. 2011 May 5;38(6):771–780. doi: 10.1016/j.nucmedbio.2011.02.002

Table 1. List of model parameters relating Cu-ATSM and FMISO uptake to tissue oxygen partial pressure.

All reduction potentials have been converted relative to the standard hydrogen electrode potential. Parenthetical ranges represent single deviation confidence intervals.

Symbol Parameter Value Reference
ÃCuATSM [61Cu]Cu-ATSM
Molar Specific Activity
237 MBq-μmol−1 [24]
ÃFMISO [18F]FMISO
Molar Specific Activity
75.0 (50.0–100.0)
GBq-μmol−1
[25]
R Gas Constant 8.31 J-mol−1-K−1 [27]
T Cellular Temperature 310 K [31]
F Faraday Constant 96.5 kJ-mol−1-V−1 [27]
ENADH0
SRPa: NAD(P)H → NAD(P)+ + H+, ne = 2 −0.320 V [16]
ECR,FAD0
SRP: Cytochrome Reductase
FAD Cofactor, ne = 1
−0.168 V [32]
ECR,FMN0
SRP: Cytochrome Reductase
FMN Cofactor, ne = 1
−0.333 V [32]
ECuATSM0
SRP: CuIIATSM → CuIATSM, ne = 1 −0.328 V [16]
EFMISO0
SRP: RNO2 → RNO2, ne = 1 −0.389 V [12]
ENR0
SRP: Complex I Nitroreductase, ne = 1 −0.250 V [33]
EO20
SRP: O2 → O2, ne = 1 −0.330 V [34]
ΔGO2Cu0
Free Energy Change: CuIATSM + O2 → CuII ATSM + O2 −22.8 kJ-mol−1 [17]
ΔGpH0
Free Energy Change: CuIATSM + H3O+ → CuIHATSM + H2O −17.1 kJ-mol−1 [30]
pH Intracellular acidity in human squamous cell carcinomas 7.20 (7.10–7.30) [35]
[H2O] Cellular water molar concentration 55.3 mol-L−1 [31]
KCR LECb: Cu-ATSM reduction −5.11 Calculated
pKpH LEC: Cu-ATSM protonation 2.88 Calculated
pKO2-Cu LEC: Cu-ATSM reoxidation 9.62 Calculated
pKNR LEC: FMISO reduction −1.12 Calculated
pKO2-F LEC: FMISO reoxidation 0.960 Calculated
KH Henry Coefficient for O2 dissolved in H2O at 310 K 959 L-atm-mol−1 Calculated
a

SRP – standard reduction potential

b

LEC – log equilibrium constant