Re: [ccp4bb] Inverse 3D profile/threading

2008-04-02 Thread Mensur Dlakic
Hi Jason, RosettaDesign server will do just that: http://rosettadesign.med.unc.edu/ You can specify that certain residues remain unchanged (say active site), that they fall into defined physico-chemical categories (polar, hyrophobic, etc), or let the server change all residues into whatever i

Re: [ccp4bb] Inverse 3D profile/threading

2008-04-02 Thread Isaac Westwood
Hi Jason, While it's not quite what you described, I'd recommend you check out the Secondary Structure Matching server at the EBI: http://www.ebi.ac.uk/msd-srv/ssm/ssmstart.html That will (hopefully!) give you previously deposited structures which share a similar fold to your query pdb file.

[ccp4bb] Inverse 3D profile/threading

2008-04-02 Thread Jason Greenwald
I am looking for software or a server to run the 3D-1D profile search in reverse: that is I have a new structure (not in yet deposited in PDB) and I want to see what sequences might fit well to this 3D structure. Can someone point me in the right direction? -jason