[ccp4bb] ccp4mg: SO4 ions

I''ve got a structure with a pile of sulphate ions in the PDB file, all in chain X. However, in the molecule selection window, these sulphates do not appear as "monomers", nor does chain X appear in the chain list: should they not be there? I can select them explicitly as "//X/*", but I'm p

Re: [ccp4bb] Reindexing data from P23 to I23

The most useful tool for sorting this out is the program Pointless, which you download from the CCP4 pre-release pages if you haven't got it already Phil On 17 Jun 2008, at 13:00, Ajit Basak wrote: Dear all, I am writing to get some help and advice - Recently one of my data which I in

Re: [ccp4bb] Arp/warp space group P 21 2 21

Dear Victor I'm glad that you see the desirability of updating Arp/warp to allow any setting. I'm a recent convert to this idea myself Best wishes Phil On 11 Jun 2008, at 09:17, [EMAIL PROTECTED] wrote: Thanks very much to everybody for useful discussion on space groups, axes and ARP/

Re: [ccp4bb] Arp/warp space group P 21 2 21

e will certainly try to introduce it. With best regards, Victor PhilEvans wrote: Is there a reason why Arp/warp doesn't like space group P 21 2 21? Phil

[ccp4bb] Arp/warp space group P 21 2 21

Is there a reason why Arp/warp doesn't like space group P 21 2 21? Phil

Re: [ccp4bb] 3D model building without CRT monitor

We now have a Planar system, which works very nicely with coot, O , ccp4mg etc. Rather expensive though Phil Evans On 2 Jun 2008, at 17:06, Mike Latchem wrote: These "new" TFT monitors do seem like a really good idea, but, it is well worth doing in depth research as most of the accessible (C

Re: [ccp4bb] hkl to mtz with anomalous data

Tim I think you could import it using COMBAT (with the "user-define" option), making a file which could be merged with Scala. Scala can also write a scaled but unmerged mtz file, but I don't whether other programs can use this It would easy for me to make POINTLESS read unmerged hkl files

Re: [ccp4bb] ccp4 install on Leopard

I've not found it necessary to activate root. I've installed quite a lot of stuff in /usr/local but found it useful to make /usr/local belong to me (sudo chown -R /usr/local). With fink, I use sudo & not found it inconvenient (you can use "sudo -s" to go into admin mode until further notic

Re: [ccp4bb] Low resol structure

The point _ought_ to be the general scientific argument, "does the experimental evidence support the conclusions made?" The questions that can be asked & answered will depend on the resolution among many other things EM blobs seem to be publishable :-) Phil On 11 Apr 2008, at 11:04, Jim