Adenylate Kinase Quotient

Check adenylate kinase mass-action quotient against an injected equilibrium value.

Description

An adenylate-kinase quotient screen compares a supplied nucleotide ratio with a chosen target.

An adenylate-kinase quotient screen compares a supplied nucleotide ratio with a chosen target. The formula fixes the reaction-quotient direction used by this tool.1

Check adenylate kinase mass-action quotient against an injected equilibrium value.

When to use Adenylate Kinase Quotient

Use this tool to check adenylate kinase mass-action quotient against an injected equilibrium value.

Prepare the measured profile, formula counts, upstream model outputs or caller-defined reference criteria requested. Keep paired entries aligned and units, sample basis and preprocessing consistent.

How to use Adenylate Kinase Quotient and understand its results

  1. Prepare the measured profile, formula counts, upstream model outputs or caller-defined reference criteria requested. Keep paired entries aligned and units, sample basis and preprocessing consistent.
  2. Enter adp, atp, amp, targetQuotient, tolerance using the field table and calculation rules, then run the tool.
  3. Read massActionQuotient, equilibriumMatch. The explanation below defines the units, signs, ordering and any flags or placeholder values.
  4. If the tool reports an input issue, correct the values and run it again. Apply the stated assumptions when interpreting a successfully returned result.
Input fieldMeaningValue type; see rules belowRequirement
adpAdpnumberRequired
atpAtpnumberRequired
ampAmpnumberRequired
targetQuotientTarget quotientnumberRequired
toleranceTolerancenumberRequired

Enter positive ATP/AMP, nonnegative ADP, target and tolerance. Return quotient and inclusive target-window flag.

quotient=ADP²/(ATP×AMP); passes=|quotient−target|≤tolerance

Units, indexing, boundary conditions and exceptional cases are defined in the calculation rules above.

Output fieldMeaningValue type
massActionQuotientMass action quotientnumber
equilibriumMatchEquilibrium matchboolean
json
{
  "input": {
    "adp": 2,
    "atp": 2,
    "amp": 2,
    "targetQuotient": 1,
    "tolerance": 0
  },
  "output": {
    "massActionQuotient": 1,
    "equilibriumMatch": true
  }
}

Limitations and assumptions

Activities, equilibrium constant, magnesium binding and reaction-direction conventions are not resolved automatically.

Numeric inputs must be finite. Follow the calculation-specific rules for overflow, underflow and exceptional cases. Missing required fields, extra fields, wrong value types and violations of the calculation rules are input errors. A successfully returned false flag is an evaluated outcome; its meaning is explained above.

Alternative or Complementary methods

Use Adenylate Energy Charge: Calculate adenylate energy charge from ATP, ADP, and AMP. For a complementary task, use Acetylcoa Coa Ratio: Calculate acetyl-CoA to free-CoA abundance ratio and acylated share.

References

  1. Adenylate Kinase Quotient — tool.io

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