HOME Back to Science page PROTEIN STRUCTURE using PyMol | |
This page is an introduction to the use of the programme PyMOL for viewing protein structures.
It is to help me remember the procedures and to guide beginners Download Word version of this guide |
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How to download Programmes | How to Download protein data files (pdb) | PyMOL instructions | An example protein (cytochrome c) |
TOP | Necessary Programme downloads |
TOP | To download Protein Data Bank (pdb) datafiles |
Instructions for using PyMOL. There are three menus: RHS top menu (TR) with drop down menus. Choose whether you want to act on the whole molecule or on what you have selected (sele) Mouse actions: These are shown in BR menu Note. Selected atoms etc are marked on screen with dots. These disappear when an area outside the structure is clicked. |
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This is a fairly typical cytochrome c which function in electron transport in a methylotrophic bacterium. Its function and structure are descibed in detail elsewhere in my page: Link to this cytochrome The structure is always presented as Lines. Even if these are replaced with ribbons etc it is a good idea to leave them until your structure is well developed. They can then be hidden (and brought back later if necessary). Show main structure as helices etc. BR/select molecules; Clk on any bit of main structure; TR/sele/Show/cartoon. Show haem in a special way. BR/select/residues. Select HEC on sequence bar; TR/sele/Show/sticks. Colour/ red Show iron as red sphere: BR/Select/atom. Clk on position of iron; TR/sele/Show/sphere; Colour/red.
Hide lines: BR Select Molecules; Clk on main structure; TR/sele/Hide lines Show final picture |
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Playing with the structure Isolation of a single helix to play with. Eg Show/sticks. This shows sticks AND helix. Hide helix by keeping the selection and TR/.Hide cartoon. |
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Download pdb file. Type in name and get brief description (left hand side below); Click on Download file and you get full description (Right hand side below). Clk Download and choose Save as pdbpdb | |
Return to Instructions | |
The 3 molecules of cytochrome cH when first downloaded in PyMol | |
Return to instructions | |
Cytochrome cH as lines with red haem Return to instructions With helices as Cartoon and coordinations to the iron in the haem. Rtn to instructions | |
The final structure Return to instructions | Isolated helix with hydrogen bonds in yellow Return to instructions |
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Structure 'slabbed' to show coordination clearly Return to instructions Stereo view. The iron atoms need to be about 7cm apart Return | |
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