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Introduction to Chemical Kinetics and Computational Modeling

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Presentation on theme: "Introduction to Chemical Kinetics and Computational Modeling"— Presentation transcript:

1 Introduction to Chemical Kinetics and Computational Modeling
Hana El-Samad Byers Hall (QB3), Rm 403D Hana El-Samad UCSB

2 Why mathematics in biology?
input output Given some initial concentrations, what is output give some prescribed input? Hana El-Samad UCSB

3 Chemical reactions are collisions of molecules
B Hana El-Samad UCSB

4 Molecule A Reactant A time Hana El-Samad UCSB

5 Reactant A time Change in Concentration: DA= A2-A1 A1 A2 t1 t2
Change in time: Dt=t2-t1 Average rate of change in concentration during time Dt= Hana El-Samad UCSB

6 Reactant A Change in Concentration: DA= A2-A1 A1 A2 t1 t2
Derivative of A with Respect to time t1 t2 instantaneous rate of change in concentration during time dt= Hana El-Samad UCSB

7 Concentration of A Rate of change of A Degradation constant
Hana El-Samad UCSB

8 Production constant Concentration of D Concentration of A
Rate of change of A Production constant Concentration of D Degradation constant Concentration of A Hana El-Samad UCSB

9 Hana El-Samad UCSB

10 Hana El-Samad UCSB

11 Hana El-Samad UCSB

12 Reaching steady-state (equilibrium)
Steady-state: No more change in A Production of A balances degradation A is constant Hana El-Samad UCSB

13 Chemical Reactions inside the cell Central Dogma of Molecular Biology
Hana El-Samad UCSB

14 Transcription start end promoter terminator gene DNA
Transcription factor start promoter end terminator gene DNA RNAP slides rapidly along DNA…Latches tightly when it encounters the promoter (sequence of nucleotides signifying start region)…Subunit of RNAP called sigma factor recognises promoter sequence…Opens up double helix, exposes nucleotides…One of the two DNA strands acts as a template for base pairing By incoming ribonucleatides (AGCU). A medium sized gene ~1500 nucleotide pairs requires 50 seconds for transcription. There maybe 15 RNAP for on one gene. Error rate is 10^-4 compared to 10^-7 in DNA replication. RNAP acts as a reading head. Hana El-Samad UCSB

15 mRNA Translation Proteins ribosomes mRNA Hana El-Samad UCSB
RNAP slides rapidly along DNA…Latches tightly when it encounters the promoter (sequence of nucleotides signifying start region)…Subunit of RNAP called sigma factor recognises promoter sequence…Opens up double helix, exposes nucleotides…One of the two DNA strands acts as a template for base pairing By incoming ribonucleatides (AGCU). A medium sized gene ~1500 nucleotide pairs requires 50 seconds for transcription. There maybe 15 RNAP for on one gene. Error rate is 10^-4 compared to 10^-7 in DNA replication. RNAP acts as a reading head. ribosomes Hana El-Samad UCSB

16 Modeling activator binding and production of mRNA
start promoter end terminator gene Fast slow Hana El-Samad UCSB

17 Fast but Hana El-Samad UCSB

18 Dissociation constant
Hana El-Samad UCSB

19 Hill Function Hana El-Samad UCSB

20 Hana El-Samad UCSB

21 Cooperativity start promoter end terminator gene Hana El-Samad UCSB

22 Cooperativity start end promoter terminator gene n molecules
Hana El-Samad UCSB

23 Repressor start promoter end terminator gene Hana El-Samad UCSB

24 Hana El-Samad UCSB


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