-----BEGIN PGP SIGNED MESSAGE----- Hash: SHA1
Hello Mikaela-- > > I am using refine.py to refine my protein structure using RDCs. I see that > the example supplies an input file with dihedral angles. What data is this > file based on and what program does it come from? I have a file of the > exact angle in the crystal structure which are close for most of the protein > and I used my chemical shifts to generate a file from TALOS of dihedral > angles, but the example file has non-precise angles with large errors. Can > someone direct me to get the type of file I need for refine.py input? Thank > you for your help! Dihedral restraints usually come from TALOS. You could also enter in more precise dihedral angles, but I suspect that distance restraints generated from the crystal structure would be more appropriate. best regards-- Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.10 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.9 <http://mailcrypt.sourceforge.net/> iEYEARECAAYFAkur/fUACgkQPK2zrJwS/lb39gCeO1aTuOefMWjQVKKRoQacFBCX soMAn0uuOnlWm2hRJzL3GoBNMnQziwEz =7iVO -----END PGP SIGNATURE-----
