begin name chassagnole1 end name begin reactions vak {1.0}atp + {1.0}asp = {1.0}aspp + {1.0}adp vasd {1.0}nadph + {1.0}aspp = {1.0}nadp + {1.0}phos + {1.0}asa vatpase {1.0}atp = {1.0}adp + {1.0}phos vhdh {1.0}nadph + {1.0}asa = {1.0}hs + {1.0}nadp vhk {1.0}hs + {1.0}atp = {1.0}hsp + {1.0}adp vnadphendo {1.0}nadph = {1.0}nadp vtsy {1.0}hsp = {1.0}thr + {1.0}phos end reactions begin rate equations vak = compartment*((vakvm13*(-((adp[t]*aspp[t])/vakkeqak) + asp[t]*atp[t]))/((1 + (vaklys/vakk1lys)^vaknak3)*(asp[t] + vakk13*(1 + aspp[t]/vakk13aspp))*(vakk13atp*(1 + adp[t]/vakk13adp) + atp[t])) + (vakvm11*(-((adp[t]*aspp[t])/vakkeqak) + asp[t]*atp[t]))/((vakk1atp*(1 + adp[t]/vakk1adp) + atp[t])*(asp[t] + (vakk11*aspp[t])/vakk1aspp + (vakk11*(1 + (thr[t]/vakk1thr)^vaknak1))/(1 + (thr[t]/(vakalpha*vakk1thr))^vaknak1)))) vasd = (compartment*vasdvm2f*(aspp[t]*nadph[t] - (asa[t]*nadp[t]*phos[t])/vasdk2eq))/((vasdk2nadph*(1 + nadp[t]/vasdk2nadp) + nadph[t])*(aspp[t] + vasdk2aspp*(1 + asa[t]/vasdk2asa)*(1 + phos[t]/vasdk2p))) vatpase = compartment*vatpasekatpase*vatpaseprot vhdh = (compartment*vhdhvm3f*(-((hs[t]*nadp[t])/vhdhk3eq) + asa[t]*nadph[t])*(1 + (thr[t]/(vhdhalpha3*vhdhk3thr))^vhdhnhdh1))/((vhdhk3asa + asa[t] + (vhdhk3asa*hs[t])/vhdhk3hs)*(vhdhk3nadph*(1 + nadp[t]/vhdhk3nadp) + nadph[t])*(1 + (thr[t]/vhdhk3thr)^vhdhnhdh1)) vhk = (compartment*vhkvm4f*atp[t]*hs[t])/((1 + vhklys/vhkk4lys)*(atp[t] + vhkk4atp*(1 + hs[t]/vhkk4ihs))*(hs[t] + vhkk4hs*(1 + atp[t]/vhkk4iatp)*(1 + thr[t]/vhkk4thr))) vnadphendo = compartment*vnadphendoknadph*vnadphendoprot*nadph[t] vtsy = (compartment*vtsyvm5*hsp[t])/(vtsyk5hsp + hsp[t]) end rate equations begin parameters vakvm11 = 0.15 vakkeqak = 0.00064 vakk11 = 0.97 vakk1thr = 0.167 vaknak1 = 4.09 vakalpha = 2.47 vakk1aspp = 0.017 vakk1atp = 0.98 vakk1adp = 0.25 vakvm13 = 0.0722 vaklys = 0.46 vakk1lys = 0.391 vaknak3 = 2.8 vakk13 = 0.32 vakk13aspp = 0.017 vakk13atp = 0.22 vakk13adp = 0.25 vasdvm2f = 0.1812 vasdk2eq = 56.4150334574039 vasdk2aspp = 0.022 vasdk2asa = 0.11 vasdk2p = 10.0 vasdk2nadph = 0.029 vasdk2nadp = 0.144 vhdhvm3f = 1.001 vhdhk3eq = 3162.27766016838 vhdhk3thr = 0.097 vhdhnhdh1 = 1.41 vhdhalpha3 = 3.93 vhdhk3asa = 0.24 vhdhk3hs = 3.39 vhdhk3nadph = 0.037 vhdhk3nadp = 0.067 vtsyvm5 = 0.0434 vtsyk5hsp = 0.31 vhkvm4f = 0.1 vhklys = 0.46 vhkk4lys = 9.45 vhkk4atp = 0.072 vhkk4ihs = 4.7 vhkk4hs = 0.11 vhkk4thr = 1.09 vhkk4iatp = 4.35 vnadphendoknadph = "5.4e-06" vnadphendoprot = 202.0 vatpasekatpase = "4.1e-05" vatpaseprot = 202.0 compartment = 1.0 end parameters begin initial conditions adp[0] = adpi asa[0] = asai asp[0] = aspi aspp[0] = asppi atp[0] = atpi hs[0] = hsi hsp[0] = hspi nadp[0] = nadpi nadph[0] = nadphi phos[0] = phosi thr[0] = thri end initial conditions begin initial values adpi = 0.0 asai = 0.0 aspi = 2.0 asppi = 0.0 atpi = 10.0 hsi = 0.0 hspi = 0.0 nadpi = 0.0 nadphi = 2.0 phosi = 0.0 thri = 2.0 end initial values begin assignment rules end assignment rules begin function definitions end function definitions begin events end events begin process annotations vak http://identifiers.org/kegg.reaction/R00480 vak http://identifiers.org/ec-code/2.7.2.4 vak http://identifiers.org/obo.go/GO:0004072 vatpase http://identifiers.org/obo.go/GO:0016887 vtsy http://identifiers.org/kegg.reaction/R01466 vtsy http://identifiers.org/ec-code/4.2.3.1 vtsy http://identifiers.org/obo.go/GO:0004795 end process annotations begin species annotations adp http://identifiers.org/obo.chebi/CHEBI:16761 adp http://identifiers.org/kegg.compound/C00008 asa http://identifiers.org/obo.chebi/CHEBI:18051 asa http://identifiers.org/kegg.compound/C00441 asp http://identifiers.org/obo.chebi/CHEBI:17053 asp http://identifiers.org/kegg.compound/C00049 aspp http://identifiers.org/obo.chebi/CHEBI:15836 aspp http://identifiers.org/kegg.compound/C03082 atp http://identifiers.org/obo.chebi/CHEBI:15422 atp http://identifiers.org/kegg.compound/C00002 hs http://identifiers.org/obo.chebi/CHEBI:15699 hs http://identifiers.org/kegg.compound/C00263 hsp http://identifiers.org/obo.chebi/CHEBI:15961 hsp http://identifiers.org/kegg.compound/C01102 nadp http://identifiers.org/obo.chebi/CHEBI:18009 nadp http://identifiers.org/kegg.compound/C00006 nadph http://identifiers.org/obo.chebi/CHEBI:16474 nadph http://identifiers.org/kegg.compound/C00005 phos http://identifiers.org/obo.chebi/CHEBI:18367 phos http://identifiers.org/kegg.compound/C00009 thr http://identifiers.org/obo.chebi/CHEBI:16857 thr http://identifiers.org/kegg.compound/C00188 end species annotations begin units end units