Re: [PyMOL] protein interaction surface

2011-03-14 Thread Thomas Holder
Hi Tomas, for structures from the PDB, PISA offers you XML download. Example: http://www.ebi.ac.uk/msd-srv/pisa/cgi-bin/interfaces.pisa?2x19 You could write a python script to load these results into PyMOL. Cheers, Thomas 2011/3/14 Tomáš Kučera: > Hello, > > yes, I tried pisa, works great, b

Re: [PyMOL] protein interaction surface

2011-03-14 Thread Thomas Holder
Hi Tomas, have you checked PISA? http://pdbe.org/pisa You can also run PISA locally, it's part of the CCP4 suite (however, the output is not that easy to parse). http://www.ccp4.ac.uk/ Cheers, Thomas 2011/3/14 Tomáš Kučera: > Hello pymol users, > > can you help me please how to calculate inter

Re: [PyMOL] protein interaction surface

2011-03-14 Thread Jason Vertrees
Hi Tomas, > I found this website http://crick.mbu.iisc.ernet.in/~PIC/index.html, > but I would rather use pymol if possible. I suggest you only use PyMOL to visualize the results of a validated calculation, or use it to run a script/program that performs the calculation and then view the results.

[PyMOL] protein interaction surface

2011-03-14 Thread Tomáš Kučera
Hello pymol users, can you help me please how to calculate interaction surface between 2 subunits of my protein? I found this website http://crick.mbu.iisc.ernet.in/~PIC/index.html, but I would rather use pymol if possible. Thanks a lot, Tomas -- S pozdravy T. Kučera -