Re: [ccp4bb] [3dem] cryoNET inaugural symposia

2018-08-30 Thread Guillermo Montoya
Dear all, just a kind reminder. Last day to register is September 7th. Looking forward meeting you in CPH best regards G. On 31 Jan 2018, at 17:49, Guillermo Montoya mailto:guillermo.mont...@cpr.ku.dk>> wrote: Dear colleagues, I am sending this email to call your atention about the cryo

[ccp4bb] Fwd: Re: [ccp4bb] coiled-coil "degree"

2018-08-30 Thread Jorge Iulek
My /acknowledgements/ to all that have replied to my question. So many interesting inputs and points to software; I will be checking in the next days. I will comment upon just some of the observations. As far as we can, we try to take as "asymmetric unit content" what is "expected" (or sometim

Re: [ccp4bb] Refmac refinement: reduced disulfides

2018-08-30 Thread Ursula Neu
Hi Joel, I'm working on a similar structure at the moment. If refining in refmac, you could add a line to the pdb such as: LINKRSG ACYS A 22 SG ACYS A 96SS and tell the program to only use links defined in the pdb file. If refining in phenix, you could

[ccp4bb] Refmac refinement: reduced disulfides

2018-08-30 Thread Joël Benjamin Heim
Dear all, I am refining structures containing disulfides using refmac. Many of the disulfides are partly broken due to radiation damage. I tried modeling alternative conformations (i.e. one cysteine pair in a disulfide and the other pair as free thiols), but after refinement the reduced form i