Difference between revisions of "Fabry:Structure-based mutation analysis"

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(Preparation)
(Preparation)
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| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0;"| 0.178
 
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| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; color: #A1C820; border-color: black"| 3HG3
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| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; font-weight: bold; border-color: black"| 3HG3
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; color: #A1C820; border-color: black"| X-ray
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| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; font-weight: bold; border-color: black"| X-ray
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; color: #A1C820; border-color: black"| 1.90
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| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; font-weight: bold; border-color: black"| 1.90
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; color: #A1C820; border-color: black"| A/B
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| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; font-weight: bold; border-color: black"| A/B
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; color: #A1C820; border-color: black"| 32-429
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| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; font-weight: bold; border-color: black"| 32-429
 
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; "| [http://www.ebi.ac.uk/pdbsum/3HG3 [»]]
 
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; "| [http://www.ebi.ac.uk/pdbsum/3HG3 [»]]
 
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; "| [http://www.pdb.org/pdb/explore/explore.do?structureId=3HG3 [»]]
 
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; "| [http://www.pdb.org/pdb/explore/explore.do?structureId=3HG3 [»]]
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; color: #A1C820; border-color: black"| 0.167
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| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0; font-weight: bold; border-color: black"| 0.167
 
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| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0;"| 3HG4
 
| style="border-style: solid; padding-left:5px; padding-right:5px; border-width: 0 1px 1px 0;"| 3HG4

Revision as of 08:47, 20 June 2012

Preparation

<figtable id="tab:XXX"> ADD CAPTION HERE

Entry Method Resolution (Å) Chain Positions PDBsum PDB R-factor
1R46 X-ray 3.25 A/B 32-429 ] ] 0.262
1R47 X-ray 3.45 A/B 32-429 ] ] 0.285
3GXN X-ray 3.01 A/B 32-429 ] ] 0.239
3GXP X-ray 2.20 A/B 32-429 ] ] 0.204
3GXT X-ray 2.70 A/B 32-429 ] ] 0.245
3HG2 X-ray 2.30 A/B 32-429 ] ] 0.178
3HG3 X-ray 1.90 A/B 32-429 ] ] 0.167
3HG4 X-ray 2.30 A/B 32-429 ] ] 0.166
3HG5 X-ray 2.30 A/B 32-429 ] ] 0.192
3LX9 X-ray 2.04 A/B 32-429 ] ] 0.178
3LXA X-ray 3.04 A/B 32-429 ] ] 0.216
3LXB X-ray 2.85 A/B 32-429 ] ] 0.227
3LXC X-ray 2.35 A/B 32-429 ] ] 0.186
3S5Y X-ray 2.10 A/B 32-429 ] ] 0.195
3S5Z X-ray 2.00 A/B 32-429 ] ] 0.211
3TV8 X-ray 2.64 A/B 32-429 ] ] 0.203

</figtable>


Vizualisation

Map all the 10 mutations onto the crystal structure.


Create mutation

SCWRL


Comparison energies

foldX

Minimise

Gromacs