begin name teusink end name begin reactions v1 {1.0}Prb + {1.0}GLCi = {1.0}G6P v10 {1.0}P2G = {1.0}PEP v11 {1.0}PEP = {1.0}PYR + {1.0}Prb v12 {1.0}PYR = {1.0}$CO2 + {1.0}ACE v13 {2.0}ACE + {3.0}NAD = {1.0}$SUCC + {3.0}NADH v14 {1.0}$GLCo = {1.0}GLCi v15 {1.0}ACE + {1.0}NADH = {1.0}NAD + {1.0}$ETOH v16 {1.0}NADH + {1.0}TRIO = {1.0}$GLY + {1.0}NAD v17 {1.0}Prb = {1.0}$X v2 {1.0}G6P = {1.0}F6P v3 {1.0}G6P + {1.0}Prb = {1.0}$Glyc v4 {2.0}G6P + {1.0}Prb = {1.0}$Trh v5 {1.0}F6P + {1.0}Prb = {1.0}F16P v6 {1.0}F16P = {2.0}TRIO v7 {1.0}TRIO + {1.0}NAD = {1.0}BPG + {1.0}NADH v8 {1.0}BPG = {1.0}P3G + {1.0}Prb v9 {1.0}P3G = {1.0}P2G end reactions begin rate equations v1 = (VmGLK*(-((G6P[t]*(SUMAXP - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/((1 - 4*KeqAK)*KeqGLK)) + (GLCi[t]*(-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/(2 - 8*KeqAK)))/(KmGLKATP*KmGLKGLCi*(1 + G6P[t]/KmGLKG6P + GLCi[t]/KmGLKGLCi)*(1 + (SUMAXP - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)/((1 - 4*KeqAK)*KmGLKADP) + (-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)/((2 - 8*KeqAK)*KmGLKATP))) v10 = (VmENO*(P2G[t] - PEP[t]/KeqENO))/(KmENOP2G*(1 + P2G[t]/KmENOP2G + PEP[t]/KmENOPEP)) v11 = (VmPYK*((PEP[t]*(SUMAXP - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/(1 - 4*KeqAK) - ((-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)*PYR[t])/((2 - 8*KeqAK)*KeqPYK)))/(KmPYKADP*KmPYKPEP*(1 + (SUMAXP - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)/((1 - 4*KeqAK)*KmPYKADP) + (-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)/((2 - 8*KeqAK)*KmPYKATP))*(1 + PEP[t]/KmPYKPEP + PYR[t]/KmPYKPYR)) v12 = (VmPDC*PYR[t]^nPDC)/(KmPDCPYR^nPDC*(1 + PYR[t]^nPDC/KmPDCPYR^nPDC)) v13 = KSUCC*ACE[t] v14 = (VmGLT*(GLCo - GLCi[t]/KeqGLT))/(KmGLTGLCo*(1 + GLCo/KmGLTGLCo + GLCi[t]/KmGLTGLCi + (0.91*GLCo*GLCi[t])/(KmGLTGLCi*KmGLTGLCo))) v15 = -((VmADH*(ETOH*NAD[t] - (ACE[t]*NADH[t])/KeqADH))/(KiADHNAD*KmADHETOH*(1 + (ETOH*KmADHNAD)/(KiADHNAD*KmADHETOH) + (KmADHNADH*ACE[t])/(KiADHNADH*KmADHACE) + NAD[t]/KiADHNAD + (ETOH*NAD[t])/(KiADHNAD*KmADHETOH) + (ETOH*ACE[t]*NAD[t])/(KiADHACE*KiADHNAD*KmADHETOH) + (KmADHNADH*ACE[t]*NAD[t])/(KiADHNAD*KiADHNADH*KmADHACE) + NADH[t]/KiADHNADH + (ETOH*KmADHNAD*NADH[t])/(KiADHNAD*KiADHNADH*KmADHETOH) + (ACE[t]*NADH[t])/(KiADHNADH*KmADHACE) + (ETOH*ACE[t]*NADH[t])/(KiADHETOH*KiADHNADH*KmADHACE)))) v16 = (VmG3PDH*(-((GLY*NAD[t])/KeqG3PDH) + (NADH[t]*TRIO[t])/(1 + KeqTPI)))/(KmG3PDHDHAP*KmG3PDHNADH*(1 + NAD[t]/KmG3PDHNAD + NADH[t]/KmG3PDHNADH)*(1 + GLY/KmG3PDHGLY + TRIO[t]/((1 + KeqTPI)*KmG3PDHDHAP))) v17 = (KATPASE*(-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/(2 - 8*KeqAK) v2 = (VmPGI*(-(F6P[t]/KeqPGI) + G6P[t]))/(KmPGIG6P*(1 + F6P[t]/KmPGIF6P + G6P[t]/KmPGIG6P)) v3 = KGLYCOGEN v4 = KTREHALOSE v5 = (gR*VmPFK*F6P[t]*(-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)*(1 + F6P[t]/KmPFKF6P + (-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)/((2 - 8*KeqAK)*KmPFKATP) + (gR*F6P[t]*(-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/((2 - 8*KeqAK)*KmPFKATP*KmPFKF6P)))/((2 - 8*KeqAK)*KmPFKATP*KmPFKF6P*((L0*(1 + (CPFKF26BP*F26BP)/KPFKF26BP + (CPFKF16BP*F16P[t])/KPFKF16BP)^2*(1 + (2*CPFKAMP*KeqAK*(SUMAXP - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)^2)/((-1 + 4*KeqAK)*KPFKAMP*(SUMAXP - Prb[t] + 4*KeqAK*Prb[t] - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)))^2*(1 + (CiPFKATP*(-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/((2 - 8*KeqAK)*KiPFKATP))^2*(1 + (CPFKATP*(-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/((2 - 8*KeqAK)*KmPFKATP))^2)/((1 + F26BP/KPFKF26BP + F16P[t]/KPFKF16BP)^2*(1 + (2*KeqAK*(SUMAXP - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)^2)/((-1 + 4*KeqAK)*KPFKAMP*(SUMAXP - Prb[t] + 4*KeqAK*Prb[t] - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)))^2*(1 + (-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)/((2 - 8*KeqAK)*KiPFKATP))^2) + (1 + F6P[t]/KmPFKF6P + (-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)/((2 - 8*KeqAK)*KmPFKATP) + (gR*F6P[t]*(-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/((2 - 8*KeqAK)*KmPFKATP*KmPFKF6P))^2)) v6 = (VmALD*(F16P[t] - (KeqTPI*TRIO[t]^2)/(KeqALD*(1 + KeqTPI)^2)))/(KmALDF16P*(1 + F16P[t]/KmALDF16P + TRIO[t]/((1 + KeqTPI)*KmALDDHAP) + (KeqTPI*TRIO[t])/((1 + KeqTPI)*KmALDGAP) + (KeqTPI*F16P[t]*TRIO[t])/((1 + KeqTPI)*KmALDF16P*KmALDGAPi) + (KeqTPI*TRIO[t]^2)/((1 + KeqTPI)^2*KmALDDHAP*KmALDGAP))) v7 = (-((VmGAPDHr*BPG[t]*NADH[t])/(KmGAPDHBPG*KmGAPDHNADH)) + (KeqTPI*VmGAPDHf*NAD[t]*TRIO[t])/((1 + KeqTPI)*KmGAPDHGAP*KmGAPDHNAD))/((1 + NAD[t]/KmGAPDHNAD + NADH[t]/KmGAPDHNADH)*(1 + BPG[t]/KmGAPDHBPG + (KeqTPI*TRIO[t])/((1 + KeqTPI)*KmGAPDHGAP))) v8 = (VmPGK*((KeqPGK*BPG[t]*(SUMAXP - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/(1 - 4*KeqAK) - (P3G[t]*(-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5))/(2 - 8*KeqAK)))/(KmPGKATP*KmPGKP3G*(1 + BPG[t]/KmPGKBPG + P3G[t]/KmPGKP3G)*(1 + (SUMAXP - (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)/((1 - 4*KeqAK)*KmPGKADP) + (-SUMAXP + Prb[t] - 4*KeqAK*Prb[t] + (SUMAXP^2 - 2*SUMAXP*Prb[t] + 8*KeqAK*SUMAXP*Prb[t] + Prb[t]^2 - 4*KeqAK*Prb[t]^2)^0.5)/((2 - 8*KeqAK)*KmPGKATP))) v9 = (VmPGM*(-(P2G[t]/KeqPGM) + P3G[t]))/(KmPGMP3G*(1 + P2G[t]/KmPGMP2G + P3G[t]/KmPGMP3G)) end rate equations begin parameters CPFKAMP = 0.0845 CPFKATP = 3.0 CPFKF16BP = 0.397 CPFKF26BP = 0.0174 CPFKF6P = 0.0 CiPFKATP = 100.0 F26BP = 0.02 KATPASE = 39.5 KGLYCOGEN = 6.0 KPFKAMP = 0.0995 KPFKF16BP = 0.111 KPFKF26BP = 0.000682 KSUCC = 21.4 KTREHALOSE = 2.4 KeqADH = "6.9e-05" KeqAK = 0.45 KeqALD = 0.069 KeqENO = 6.7 KeqG3PDH = 4300.0 KeqGLK = 3800.0 KeqGLT = 1.0 KeqPGI = 0.314 KeqPGK = 3200.0 KeqPGM = 0.19 KeqPYK = 6500.0 KeqTPI = 0.045 KiADHACE = 1.1 KiADHETOH = 90.0 KiADHNAD = 0.92 KiADHNADH = 0.031 KiPFKATP = 0.65 KmADHACE = 1.11 KmADHETOH = 17.0 KmADHNAD = 0.17 KmADHNADH = 0.11 KmALDDHAP = 2.4 KmALDF16P = 0.3 KmALDGAP = 2.0 KmALDGAPi = 10.0 KmENOP2G = 0.04 KmENOPEP = 0.5 KmG3PDHDHAP = 0.4 KmG3PDHGLY = 1.0 KmG3PDHNAD = 0.93 KmG3PDHNADH = 0.023 KmGAPDHBPG = 0.0098 KmGAPDHGAP = 0.21 KmGAPDHNAD = 0.09 KmGAPDHNADH = 0.06 KmGLKADP = 0.23 KmGLKATP = 0.15 KmGLKG6P = 30.0 KmGLKGLCi = 0.08 KmGLTGLCi = 1.1918 KmGLTGLCo = 1.1918 KmPDCPYR = 4.33 KmPFKATP = 0.71 KmPFKF6P = 0.1 KmPGIF6P = 0.3 KmPGIG6P = 1.4 KmPGKADP = 0.2 KmPGKATP = 0.3 KmPGKBPG = 0.003 KmPGKP3G = 0.53 KmPGMP2G = 0.08 KmPGMP3G = 1.2 KmPYKADP = 0.53 KmPYKATP = 1.5 KmPYKPEP = 0.14 KmPYKPYR = 21.0 L0 = 0.66 SUMAXP = 4.1 VmADH = 810.0 VmALD = 322.258 VmENO = 365.806 VmG3PDH = 70.15 VmGAPDHf = 1184.52 VmGAPDHr = 6549.68 VmGLK = 226.452 VmGLT = 97.264 VmPDC = 174.194 VmPFK = 182.903 VmPGI = 339.677 VmPGK = 1306.45 VmPGM = 2525.81 VmPYK = 1088.71 gR = 5.12 nPDC = 1.9 CO2 = 1.0 ETOH = 50.0 GLCo = 50.0 GLY = 0.15 Glyc = 0.0 SUCC = 0.0 Trh = 0.0 X = 0.0 defaultcompartment = 1.0 end parameters begin initial conditions ACE[0] = ACEi BPG[0] = BPGi F16P[0] = F16Pi F6P[0] = F6Pi G6P[0] = G6Pi GLCi[0] = GLCii NAD[0] = NADi NADH[0] = NADHi P2G[0] = P2Gi P3G[0] = P3Gi PEP[0] = PEPi PYR[0] = PYRi Prb[0] = Prbi TRIO[0] = TRIOi end initial conditions begin initial values ACEi = 0.04 BPGi = 0.0 F16Pi = 0.1 F6Pi = 0.28 G6Pi = 1.39 GLCii = 0.087 NADi = 1.2 NADHi = 0.39 P2Gi = 0.1 P3Gi = 0.1 PEPi = 0.1 PYRi = 3.36 Prbi = 5.0 TRIOi = 5.17 end initial values begin assignment rules end assignment rules begin function definitions end function definitions begin events end events begin process annotations v_1 http://identifiers.org/interpro/IPR001312 v_1 http://identifiers.org/ec-code/2.7.1.1 v_10 urn:miriam:kegg.reaction:R01518 v_11 urn:miriam:kegg.reaction:R00658 v_12 urn:miriam:kegg.reaction:R00200 v_13 urn:miriam:kegg.reaction:R00224 v_15 urn:miriam:kegg.reaction:R00754 v_16 http://identifiers.org/ec-code/1.1.1.94 v_17 urn:miriam:obo.go:0006200 v_2 urn:miriam:kegg.reaction:R00299 v_5 urn:miriam:kegg.reaction:R02740 v_6 urn:miriam:kegg.reaction:R04779 v_6 http://identifiers.org/ec-code/2.7.1.11 v_7 urn:miriam:kegg.reaction:R01068 v_8 urn:miriam:kegg.reaction:R01061 v_9 urn:miriam:kegg.reaction:R01512 end process annotations begin species annotations ACE http://identifiers.org/obo.chebi/CHEBI%3A15343 BPG urn:miriam:obo.chebi:28907 BPG urn:miriam:kegg.compound:C00236 CO2 http://identifiers.org/obo.chebi/CHEBI%3A16526 ETOH http://identifiers.org/obo.chebi/CHEBI%3A16236 F16P urn:miriam:obo.chebi:16905 F16P urn:miriam:kegg.compound:C00354 F6P urn:miriam:kegg.compound:C00085 F6P urn:miriam:obo.chebi:15946 G6P urn:miriam:kegg.compound:C00092 G6P urn:miriam:obo.chebi:17665 GLCi http://identifiers.org/obo.chebi/CHEBI%3A17234 GLCo http://identifiers.org/obo.chebi/CHEBI%3A17234 GLY http://identifiers.org/obo.chebi/CHEBI%3A17754 Glyc http://identifiers.org/obo.chebi/CHEBI%3A28087 NAD urn:miriam:obo.chebi:15846 NADH urn:miriam:obo.chebi:16908 NADH urn:miriam:kegg.compound:C00004 P2G urn:miriam:kegg.compound:C00631 P2G urn:miriam:obo.chebi:17835 P3G urn:miriam:kegg.compound:C00197 P3G urn:miriam:obo.chebi:17794 PEP urn:miriam:obo.chebi:18021 PEP urn:miriam:kegg.compound:C00074 PYR urn:miriam:obo.chebi:15361 PYR urn:miriam:kegg.compound:C00022 SUCC http://identifiers.org/obo.chebi/CHEBI%3A15741 SUCC http://identifiers.org/kegg.compound/C00042 TRIO http://identifiers.org/obo.chebi/CHEBI%3A29052 TRIO http://identifiers.org/kegg.compound/C00111 Trh http://identifiers.org/obo.chebi/CHEBI%3A27082 end species annotations begin units end units