Role of NADH/NAD+ transport activity and glycogen store on skeletal muscle energy metabolism during exercise: in silico studies.

Skeletal muscle can maintain ATP concentration constant during the transition from rest to exercise, whereas metabolic reaction rates may increase substantially. Among the key regulatory factors of skeletal muscle energy metabolism during exercise, the dynamics of cytosolic and mitochondrial NADH and NAD+ have not been characterized. To quantify these regulatory factors, we have developed a physiologically based computational model of skeletal muscle energy metabolism. This model integrates transport and reaction fluxes in distinct capillary, cytosolic, and mitochondrial domains and investigates the roles of mitochondrial NADH/NAD+ transport (shuttling) activity and muscle glycogen concentration (stores) during moderate intensity exercise (60% maximal O2 consumption). The underlying hypothesis is that the cytosolic redox state (NADH/NAD+) is much more sensitive to a metabolic disturbance in contracting skeletal muscle than the mitochondrial redox state. This hypothesis was tested by simulating the dynamic metabolic responses of skeletal muscle to exercise while altering the transport rate of reducing equivalents (NADH and NAD+) between cytosol and mitochondria and muscle glycogen stores. Simulations with optimal parameter estimates showed good agreement with the available experimental data from muscle biopsies in human subjects. Compared with these simulations, a 20% increase (or approximately 20% decrease) in mitochondrial NADH/NAD+ shuttling activity led to an approximately 70% decrease (or approximately 3-fold increase) in cytosolic redox state and an approximately 35% decrease (or approximately 25% increase) in muscle lactate level. Doubling (or halving) muscle glycogen concentration resulted in an approximately 50% increase (or approximately 35% decrease) in cytosolic redox state and an approximately 30% increase (or approximately 25% decrease) in muscle lactate concentration. In both cases, changes in mitochondrial redox state were minimal. In conclusion, the model simulations of exercise response are consistent with the hypothesis that mitochondrial NADH/NAD+ shuttling activity and muscle glycogen stores affect primarily the cytosolic redox state. Furthermore, muscle lactate production is regulated primarily by the cytosolic redox state.

[1]  M. Spencer,et al.  Role of glycogen in control of glycolysis and IMP formation in human muscle during exercise. , 1991, The American journal of physiology.

[2]  J. Huss,et al.  Role of calcineurin in exercise-induced mitochondrial biogenesis. , 2006, American journal of physiology. Endocrinology and metabolism.

[3]  B Korzeniewski,et al.  Regulation of ATP supply in mammalian skeletal muscle during resting state-->intensive work transition. , 2000, Biophysical chemistry.

[4]  B. Saltin,et al.  Human Skeletal Muscle Fatty Acid and Glycerol Metabolism During Rest, Exercise and Recovery , 2002, The Journal of physiology.

[5]  Thomas J Barstow,et al.  Muscle capillary blood flow kinetics estimated from pulmonary O2 uptake and near-infrared spectroscopy. , 2005, Journal of applied physiology.

[6]  B. Korzeniewski,et al.  A model of oxidative phosphorylation in mammalian skeletal muscle. , 2001, Biophysical chemistry.

[7]  Daniel A Beard,et al.  Analysis of cardiac mitochondrial Na+–Ca2+ exchanger kinetics with a biophysical model of mitochondrial Ca2+ handing suggests a 3: 1 stoichiometry , 2008, The Journal of physiology.

[8]  H. Qian,et al.  Energy balance for analysis of complex metabolic networks. , 2002, Biophysical journal.

[9]  Lufang Zhou,et al.  Mechanistic model of cardiac energy metabolism predicts localization of glycolysis to cytosolic subdomain during ischemia. , 2005, American journal of physiology. Heart and circulatory physiology.

[10]  Daniel A. Beard,et al.  A Biophysical Model of the Mitochondrial Respiratory System and Oxidative Phosphorylation , 2005, PLoS Comput. Biol..

[11]  U. F. Rasmussen The oxidation of added NADH by intact heart mitochondria , 1969, FEBS letters.

[12]  B. Saltin,et al.  Effect of muscle glycogen on glucose, lactate and amino acid metabolism during exercise and recovery in human subjects , 1999, The Journal of physiology.

[13]  L. Gladden Lactate metabolism: a new paradigm for the third millennium , 2004, The Journal of physiology.

[14]  R. Robergs,et al.  Biochemistry of exercise-induced metabolic acidosis. , 2004, American journal of physiology. Regulatory, integrative and comparative physiology.

[15]  Beatriz Pardo,et al.  Mitochondrial transporters as novel targets for intracellular calcium signaling. , 2007, Physiological reviews.

[16]  M. Brand,et al.  Top-down control analysis of ATP turnover, glycolysis and oxidative phosphorylation in rat hepatocytes. , 1999, European journal of biochemistry.

[17]  R. Beitner,et al.  Control of glycolytic enzymes through binding to cell structures and by glucose-1,6-bisphosphate under different conditions. The role of Ca2+ and calmodulin. , 1993, The International journal of biochemistry.

[18]  E. Richter,et al.  Increased plasma FFA uptake and oxidation during prolonged exercise in trained vs. untrained humans. , 1992, The American journal of physiology.

[19]  F. Plum Handbook of Physiology. , 1960 .

[20]  B J Whipp,et al.  Modulation of muscle and pulmonary O2 uptakes by circulatory dynamics during exercise. , 1990, Journal of applied physiology.

[21]  P W Hochachka,et al.  Cellular metabolic homeostasis during large-scale change in ATP turnover rates in muscles. , 1997, The Journal of experimental biology.

[22]  M. Palacín,et al.  Role of plasma membrane transporters in muscle metabolism. , 2000, The Biochemical journal.

[23]  J. Mccormack,et al.  Role of calcium ions in regulation of mammalian intramitochondrial metabolism. , 1990, Physiological reviews.

[24]  A. Bonen The expression of lactate transporters (MCT1 and MCT4) in heart and muscle , 2001, European Journal of Applied Physiology.

[25]  Arsenio Veicsteinas,et al.  Heart rate variability and autonomic activity at rest and during exercise in various physiological conditions , 2003, European Journal of Applied Physiology.

[26]  S. Vatner,et al.  Limited transfer of cytosolic NADH into mitochondria at high cardiac workload. , 2004, American journal of physiology. Heart and circulatory physiology.

[27]  R. Alberty Thermodynamics of Biochemical Reactions: Alberty/Thermodynamics , 2005 .

[28]  E Hultman,et al.  Regulation of glycogen phosphorylase and PDH during exercise in human skeletal muscle during hypoxia. , 2000, American journal of physiology. Endocrinology and metabolism.

[29]  G. M. Saidel,et al.  Relating pulmonary oxygen uptake to muscle oxygen consumption at exercise onset: in vivo and in silico studies , 2006, European Journal of Applied Physiology.

[30]  K. Sahlin,et al.  Regulation of lactic acid production during exercise. , 1988, Journal of applied physiology.

[31]  R. Alberty Calculation of standard transformed Gibbs energies and standard transformed enthalpies of biochemical reactants. , 1998, Archives of biochemistry and biophysics.

[32]  Gerald M. Saidel,et al.  Modeling Cellular Metabolism and Energetics in Skeletal Muscle: Large-Scale Parameter Estimation and Sensitivity Analysis , 2008, IEEE Transactions on Biomedical Engineering.

[33]  Daniel A. Beard,et al.  Modeling of Oxygen Transport and Cellular Energetics Explains Observations on In Vivo Cardiac Energy Metabolism , 2006, PLoS Comput. Biol..

[34]  G. Brown,et al.  Control of respiration and ATP synthesis in mammalian mitochondria and cells. , 1992, The Biochemical journal.

[35]  M. Gibala,et al.  Effect of endurance training on muscle TCA cycle metabolism during exercise in humans. , 2004, Journal of applied physiology.

[36]  K. Sahlin,et al.  Tricarboxylic acid cycle intermediates in human muscle during prolonged exercise. , 1990, The American journal of physiology.

[37]  D. Kipnis,et al.  Alanine and glutamine synthesis and release from skeletal muscle. II. The precursor role of amino acids in alanine and glutamine synthesis. , 1976, The Journal of biological chemistry.

[38]  Lufang Zhou,et al.  Parallel activation of mitochondrial oxidative metabolism with increased cardiac energy expenditure is not dependent on fatty acid oxidation in pigs , 2007, The Journal of physiology.

[39]  I. Hassinen Mitochondrial respiratory control in the myocardium. , 1986, Biochimica et biophysica acta.

[40]  H. Qian,et al.  Relationship between Thermodynamic Driving Force and One-Way Fluxes in Reversible Processes , 2006, PloS one.

[41]  M. Chandler,et al.  Regulation of pyruvate dehydrogenase activity and citric acid cycle intermediates during high cardiac power generation , 2005, The Journal of physiology.

[42]  D. Kipnis,et al.  Alanine and glutamine synthesis and release from skeletal muscle. I. Glycolysis and amino acid release. , 1976, The Journal of biological chemistry.

[43]  B. Saltin,et al.  Skeletal muscle substrate utilization during submaximal exercise in man: effect of endurance training. , 1993, The Journal of physiology.

[44]  James B. Bassingthwaighte,et al.  Blood HbO2 and HbCO2 Dissociation Curves at Varied O2, CO2, pH, 2,3-DPG and Temperature Levels , 2004, Annals of Biomedical Engineering.

[45]  Mark Hargreaves,et al.  Adrenaline increases skeletal muscle glycogenolysis, pyruvate dehydrogenase activation and carbohydrate oxidation during moderate exercise in humans , 2001, The Journal of physiology.

[46]  W. Kunz Control of oxidative phosphorylation in skeletal muscle. , 2001, Biochimica et biophysica acta.

[47]  R S Balaban,et al.  Regulation of oxidative phosphorylation in the mammalian cell. , 1990, The American journal of physiology.

[48]  T. Barstow,et al.  Comparison of oxygen uptake kinetics during knee extension and cycle exercise. , 2005, American journal of physiology. Regulatory, integrative and comparative physiology.

[49]  T. M. Devlin,et al.  Textbook of biochemistry: With clinical correlations , 1982 .

[50]  D. Beard,et al.  Modeling of Cellular Metabolism and Microcirculatory Transport , 2008, Microcirculation.

[51]  D. Ranney,et al.  Adaptations in muscle metabolism to prolonged voluntary exercise and training. , 1995, Journal of applied physiology.

[52]  A. E. Gent,et al.  An unusual metabolic myopathy: a malate—aspartate shuttle defect , 1987, Journal of the Neurological Sciences.

[53]  A. Lansner,et al.  A mathematical model of the mitochondrial NADH shuttles and anaplerosis in the pancreatic beta-cell. , 2007, American journal of physiology. Endocrinology and metabolism.

[54]  B. Saltin,et al.  Dissociation between muscle tricarboxylic acid cycle pool size and aerobic energy provision during prolonged exercise in humans , 2002, The Journal of physiology.

[55]  J. Henriksson,et al.  NADH content in type I and type II human muscle fibres after dynamic exercise. , 1988, The Biochemical journal.

[56]  P. Schantz,et al.  Enzyme levels of the NADH shuttle systems: measurements in isolated muscle fibres from humans of differing physical activity. , 1987, Acta physiologica Scandinavica.

[57]  G. Dobson,et al.  Adjustment of K' for the creatine kinase, adenylate kinase and ATP hydrolysis equilibria to varying temperature and ionic strength. , 1996, The Journal of experimental biology.

[58]  I. H. Segel Enzyme Kinetics: Behavior and Analysis of Rapid Equilibrium and Steady-State Enzyme Systems , 1975 .

[59]  Gerald M. Saidel,et al.  Metabolic Dynamics in Skeletal Muscle during Acute Reduction in Blood Flow and Oxygen Supply to Mitochondria: In-Silico Studies Using a Multi-Scale, Top-Down Integrated Model , 2008, PloS one.

[60]  Bernard Korzeniewski,et al.  Metabolic control over the oxygen consumption flux in intact skeletal muscle: in silico studies. , 2006, American journal of physiology. Cell physiology.

[61]  M. Spencer,et al.  Effect of low glycogen on carbohydrate and energy metabolism in human muscle during exercise. , 1992, The American journal of physiology.

[62]  Andrew Garnham,et al.  Glycogen availability does not affect the TCA cycle or TAN pools during prolonged, fatiguing exercise. , 2003, Journal of applied physiology.

[63]  B. Korzeniewski Theoretical studies on how ATP supply meets ATP demand. , 1999, Biochemical Society transactions.

[64]  Gerald M. Saidel,et al.  Linking Pulmonary Oxygen Uptake, Muscle Oxygen Utilization and Cellular Metabolism during Exercise , 2007, Annals of Biomedical Engineering.

[65]  W. L. Elban,et al.  Crystal size dependence for impact initiation of cyclotrimethylenetrinitramine explosive , 1990 .

[66]  L. Rowell,et al.  Exercise : regulation and integration of multiple systems , 1996 .

[67]  J E Parrillo,et al.  Malate-aspartate shuttle, cytoplasmic NADH redox potential, and energetics in vascular smooth muscle. , 1998, Journal of molecular and cellular cardiology.

[68]  J. Mccormack,et al.  The role of mitochondrial Ca2+ transport and matrix Ca2+ in signal transduction in mammalian tissues. , 1990, Biochimica et biophysica acta.

[69]  N. Oyama,et al.  Ca2+-dependent activation of the malate-aspartate shuttle by norepinephrine and vasopressin in perfused rat liver. , 1988, Archives of biochemistry and biophysics.

[70]  P. Pinton,et al.  Recombinant Expression of the Ca2+-sensitive Aspartate/Glutamate Carrier Increases Mitochondrial ATP Production in Agonist-stimulated Chinese Hamster Ovary Cells* , 2003, Journal of Biological Chemistry.

[71]  B. Saltin,et al.  Estimation of the mitochondrial redox state in human skeletal muscle during exercise. , 1989, Journal of applied physiology.

[72]  B. Saltin,et al.  Tricarboxylic acid cycle intermediate pool size and estimated cycle flux in human muscle during exercise. , 1998, The American journal of physiology.

[73]  P. Felig,et al.  Substrate turnover during prolonged exercise in man. Splanchnic and leg metabolism of glucose, free fatty acids, and amino acids. , 1974, The Journal of clinical investigation.

[74]  Melissa L Kemp,et al.  Dynamics of muscle glycogenolysis modeled with pH time course computation and pH-dependent reaction equilibria and enzyme kinetics. , 2006, Biophysical journal.

[75]  H. Qian,et al.  Thermodynamic constraints for biochemical networks. , 2004, Journal of theoretical biology.

[76]  G. Dalsky,et al.  Muscle triglyceride utilization during exercise: effect of training. , 1986, Journal of applied physiology.

[77]  L. Spriet,et al.  Regulation of skeletal muscle fat oxidation during exercise in humans. , 2002, Medicine and science in sports and exercise.

[78]  A. Mader Glycolysis and oxidative phosphorylation as a function of cytosolic phosphorylation state and power output of the muscle cell , 2002, European Journal of Applied Physiology.

[79]  B Korzeniewski,et al.  Regulation of ATP supply during muscle contraction: theoretical studies. , 1998, The Biochemical journal.

[80]  Martin J. Kushmerick,et al.  A Computational Model for Glycogenolysis in Skeletal Muscle , 2002, Annals of Biomedical Engineering.

[81]  Lufang Zhou,et al.  Regulation of lactate production at the onset of ischaemia is independent of mitochondrial NADH/NAD+: insights from in silico studies , 2005, The Journal of physiology.

[82]  J. Coast Handbook of Physiology. Section 12. Exercise: Regulation and Integration of Multiple Systems , 1997 .

[83]  A. Lehninger Principles of Biochemistry , 1984 .

[84]  C. Juel,et al.  Lactate transport in skeletal muscle — role and regulation of the monocarboxylate transporter , 1999, The Journal of physiology.

[85]  Lufang Zhou,et al.  Regulation of myocardial substrate metabolism during increased energy expenditure: insights from computational studies. , 2006, American journal of physiology. Heart and circulatory physiology.

[86]  R. Connett Glycolytic regulation during an aerobic rest-to-work transition in dog gracilis muscle. , 1987, Journal of applied physiology.

[87]  Bernard Korzeniewski,et al.  Theoretical studies on the regulation of anaerobic glycolysis and its influence on oxidative phosphorylation in skeletal muscle. , 2004, Biophysical chemistry.

[88]  A. Katz,et al.  G-1,6-P2, glycolysis, and energy metabolism during circulatory occlusion in human skeletal muscle. , 1988, The American journal of physiology.

[89]  P W Hochachka,et al.  Regulating ATP turnover rates over broad dynamic work ranges in skeletal muscles. , 1992, Journal of applied physiology.

[90]  G. Heigenhauser,et al.  Progressive effect of endurance training on metabolic adaptations in working skeletal muscle. , 1996, The American journal of physiology.

[91]  J. Leigh,et al.  Lactate efflux from exercising human skeletal muscle: role of intracellular PO2. , 1998, Journal of applied physiology.

[92]  Leon S. Lasdon,et al.  Design and Testing of a Generalized Reduced Gradient Code for Nonlinear Programming , 1978, TOMS.

[93]  Robert A. Harris,et al.  Metabolic Regulation in Mammals , 2001 .

[94]  R. Alberty Thermodynamics of Biochemical Reactions , 2003 .

[95]  J. Henriksson,et al.  Redox state and lactate accumulation in human skeletal muscle during dynamic exercise. , 1987, The Biochemical journal.

[96]  D. Smith,et al.  Early muscular and metabolic adaptations to prolonged exercise training in humans. , 1991, Journal of applied physiology.

[97]  Daniel A Beard,et al.  Oxidative ATP synthesis in skeletal muscle is controlled by substrate feedback. , 2007, American journal of physiology. Cell physiology.

[98]  M. Brand,et al.  Calcium regulation of oxidative phosphorylation in rat skeletal muscle mitochondria. , 2000, Biochimica et biophysica acta.

[99]  A. Bonen,et al.  Long-chain fatty acid uptake and FAT/CD36 translocation in heart and skeletal muscle. , 2005, Biochimica et biophysica acta.

[100]  G. Dudley,et al.  Muscle use during dynamic knee extension: implication for perfusion and metabolism. , 1998, Journal of applied physiology.

[101]  G. Heigenhauser,et al.  Effects of short-term submaximal training in humans on muscle metabolism in exercise. , 1998, American Journal of Physiology. Endocrinology and Metabolism.

[102]  H. Krebs,et al.  The redox state of free nicotinamide-adenine dinucleotide in the cytoplasm and mitochondria of rat liver. , 1967, The Biochemical journal.

[103]  L. Jorfeldt,et al.  Glucose metabolism during leg exercise in man. , 1971, The Journal of clinical investigation.

[104]  James B. Bassingthwaighte,et al.  Simultaneous Blood–Tissue Exchange of Oxygen, Carbon Dioxide, Bicarbonate, and Hydrogen Ion , 2006, Annals of Biomedical Engineering.

[105]  R. Dash,et al.  A computational model of skeletal muscle metabolism linking cellular adaptations induced by altered loading states to metabolic responses during exercise , 2007, Biomedical engineering online.

[106]  Gregory J. Crowther,et al.  Control of glycolysis in contracting skeletal muscle. I. Turning it on. , 2002, American journal of physiology. Endocrinology and metabolism.

[107]  A Katz,et al.  Failure of glutamate dehydrogenase system to predict oxygenation state of human skeletal muscle. , 1990, The American journal of physiology.

[108]  B. Korzeniewski Oxygen consumption and metabolite concentrations during transitions between different work intensities in heart. , 2006, American journal of physiology. Heart and circulatory physiology.

[109]  M. Gibala,et al.  Effects of 7 wk of endurance training on human skeletal muscle metabolism during submaximal exercise. , 2004, Journal of applied physiology.