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Hi Lizhe-- > > I have several identical proteins in one unit cell, whose segid are > SEGA, SEGB and so on. > > I induced NOE by assi (resid 36 and name CB ) (resid 42 and name CG ) > 6.50 4.00 1.00 > > So will Xplor know this is the NOE restraint within one protein, > instead of a restraint between two proteins, like CB atom of SEGA's > 36th residue and CG atom of SEGB's 42 residue? > no- this will sum over all atoms which match the selections. If 1/r^6 averaging is used, in practise, it picks out the shortest distance. Anyway, this is a single distance restraint. With a multimer, you will probably want one restraint for each subunit. best regards-- Charles -----BEGIN PGP SIGNATURE----- Version: GnuPG v1.4.10 (GNU/Linux) Comment: Processed by Mailcrypt 3.5.8+ <http://mailcrypt.sourceforge.net/> iEYEARECAAYFAksC5wAACgkQPK2zrJwS/lYL1wCggizsClfCpUTC5y/qeOBYU3Lo 61cAniYWxC+rs7ZDLefTldHUAr3Txcbl =hepE -----END PGP SIGNATURE-----
