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iCn3D Mutation Analysis

Author: Alexa M. Salsbury, PhD

iCn3D Shortcuts and Help Docs

 

1. Go to 1TUP(MMDB) in iCn3D

Note: you can use your previous rendering or start fresh

2. Click on Select > by Distance
Screenshot from the iCn3D website, Select > by distance

3. Choose nucleotides, set sphere radius to 3.5 Å, choose 1TUP_B, and click on Display
Screenshot from the iCn3D website, Select a sphere around a set


4. Select Style > Side Chains > Stick to better view these residues
Screenshot from the iCn3D website, Style > Side Chains > Stick

5. Click Select > Save Selection and name resi_3.5_dna
Screenshot from the iCn3D website, Select > Save Selection

6. In Defined Sets, Select nucleotides +Ctrl resi_5a_zn and View > View Selection to view DNA and the interacting residuesScreenshot from the iCn3D website, View > View Selection

7. View residue Lys120
Note: A handful of residues interacting with the DNA. Lys120 is of particular interest because it’s pointing into the major groove and it’s a positively charged residue.Screenshot from the iCn3D website, Residues interacting with the DNA major groove


8. Click Analysis > Mutation to perform mutation analysis on Lys120
Screenshot from the iCn3D website, Show the mutations in 3D

9. Type A to alternate between K120 and A120
Screenshot from the iCn3D website, Interactions in Wild Type of 1TUP

Screenshot from the iCn3D website,  Interactions in mutated of 1TUP2


10. Review Key
Screenshot from the iCn3D website,  Key of interactions

11. Review interaction maps
Screenshot from the iCn3D website,  Interactions map


12. Review different interaction maps
Screenshot from the iCn3D website,  Different nteractions map

13. View Defined Sets by Analysis > Defined Sets to take a closer look at specific interactions
Screenshot from the iCn3D website,  1TUP and Defined Sets

 

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Last Reviewed: October 18, 2022