The document provides instructions for Module 4 Assignment Question 1 which asks the student to:
1) Select the human β2-adrenergic receptor from the Protein Data Bank and epinephrine file to model their interaction using AutoDock
2) Document the grid creation process including the covalent grid parameter amino acid residue chosen
3) Report the top 3 docking results based on amino acid residue interactions
4) Include the documentation, grid and docking files in the submission
The document provides instructions for Module 4 Assignment Question 1 which asks the student to:
1) Select the human β2-adrenergic receptor from the Protein Data Bank and epinephrine file to model their interaction using AutoDock
2) Document the grid creation process including the covalent grid parameter amino acid residue chosen
3) Report the top 3 docking results based on amino acid residue interactions
4) Include the documentation, grid and docking files in the submission
The document provides instructions for Module 4 Assignment Question 1 which asks the student to:
1) Select the human β2-adrenergic receptor from the Protein Data Bank and epinephrine file to model their interaction using AutoDock
2) Document the grid creation process including the covalent grid parameter amino acid residue chosen
3) Report the top 3 docking results based on amino acid residue interactions
4) Include the documentation, grid and docking files in the submission
Question 1: Module 4 covered the interactions of epinephrine with β-adrenergic receptors as a
full agonist. The task at hand now is to model the interaction between epinephrine and the human β2-adrenergic receptor using AutoDock. You need to document which receptor you selected from the Protein data bank (http://www.rcsb.org/pdb/home/home.do (Links to an external site.)) and which file you used for epinephrine from the same database. Document your steps in creating the grid, especially which amino acid residue you chose as the covalent grid parameter, and what the top 3 docking results are in regards to the amino acid residue interactions. You may want to go back to assignment 1 and listen to the YouTube tutorial by John Cahill (https://youtu.be/ZiuqSzqcD7M (Links to an external site.)). Your submission needs to include the documentation as well as the grid and docking files.
https://www.youtube.com/watch?v=ZiuqSzqcD7M
You can once again use Discovery Studio Visualizer (https://discover.3ds.com/discovery-studio-
visualizer-download (Links to an external site.)) to display the amino acid-ligand interactions.
Always provide references with your assignment submissions.