[ccp4bb] HETATM automated chain assignment

2013-02-15 Thread Talon Romain
Hello to the CCP4 bulletin board community, I would like to know if I could find a tool to automatically assign HETATM atom (or even, water molecules) to the nearest protein chain ? In my case, I have 4 protein chains in the asymmetric unit : A, B, C and D. I would like to assign each ions

Re: [ccp4bb] HETATM automated chain assignment

2013-02-15 Thread Miller, Mitchell D.
-atom ions, but could work for Na, Cl, K, Mg, Ca etc Regards, Mitch -Original Message- From: CCP4 bulletin board [mailto:CCP4BB@JISCMAIL.AC.UK] On Behalf Of Talon Romain Sent: Friday, February 15, 2013 8:30 AM To: CCP4BB@JISCMAIL.AC.UK Subject: [ccp4bb] HETATM automated chain

Re: [ccp4bb] HETATM automated chain assignment

2013-02-15 Thread M T
Dear Romain, I already ask this question to someone of the pdb staff during a deposition process, and he answer me that it is an in house program and they don't distribute theirs in house programs, so if this direction hit your mind, you can forget it directly. Meow... 2013/2/15 Talon Romain