[ccp4bb] off-topic: glycans

2021-06-28 Thread Sam Tang
Dear community Sorry for an off-topic question here. I wonder if anyone may be aware of any glycan modification database where we can predict what is what. For example, if I got a mass difference of m/z X on LC-MS, and I would like to have a rough idea what it might be, where should I go for?

[ccp4bb] pdb2ins "cannot open self"

2021-06-28 Thread James Holton
Greetings all, I hope everyone had a nice weekend. I'm also writing to report what might be a bug in the version of pdb2ins distributed with CCP4.  On some (but not all) of my linux systems I'm getting this error message from pdb2ins at random.  If I run the same command ~10 times in a row,

[ccp4bb] PostDoc POSITION

2021-06-28 Thread Greg Snyder
A postdoctoral position is available immediately to participate in an inter-disciplinary research program on biophysical studies of HIV proteins and virions at the Institute of Human Virology of University of Maryland School of Medicine, Baltimore, MD. We are looking for a highly motivated

Re: [ccp4bb] saving coordinates with respect to map in ChimeraX

2021-06-28 Thread Tristan Croll
The way things generally work in ChimeraX is that each model/map is stored internally with its original coordinates unchanged, along with one or more transforms placing it into scene coordinates. Saving model A relative to model/map B means that the coordinates to be saved are transformed such

Re: [ccp4bb] saving coordinates with respect to map in ChimeraX

2021-06-28 Thread Jon Cooper
It's not important, but I am curious what 'Save relative to model/map' actually means in that widget. Is it just a case of copying the relevant CRYST1 card? I think Faisal is asking how to save new/modified coordinates but probably I misunderstood... Cheers, Jon.C. Sent from ProtonMail mobile

[ccp4bb] Group/Team leader position available@EMBL Hamburg

2021-06-28 Thread Margret Fischer
Dear colleagues, I would like to inform you that the EMBL Hamburg Unit is currently advertising for a Group/Team leader position. *Reference Number HH00201*: Group/Team leader - Integrated X-ray based structural biology and dynamics. /Closing date: 8th August 2021/ Further detailed

Re: [ccp4bb] saving coordinates with respect to map in ChimeraX

2021-06-28 Thread Tristan Croll
Hi Faisal, Are you using the latest version (1.2.5)? That should give you a dialog that looks something like this. Best regards, Tristan [cid:c60bb51b-6f11-4646-9800-6ce976abc3f0] From: khaja faisal tarique Sent: 28 June 2021 10:29 To: Tristan Croll Cc:

Re: [ccp4bb] saving coordinates with respect to map in ChimeraX

2021-06-28 Thread khaja faisal tarique
Hi Tristan I have posted my question in ChimeraX mailing list as well and waiting for their reply. What you are suggesting is for Chimera. I dont see any such option in ChimeraX. That save relative to section does not appear here or may be there is a different way of saving model relative to map

Re: [ccp4bb] saving coordinates with respect to map in ChimeraX

2021-06-28 Thread Tristan Croll
Hi Faisal, This is really a question for the ChimeraX-users list (chimerax-us...@cgl.ucsf.edu). But the quick run-down: using the File/Save dialogue, you'll see a checkbox with "Save relative to model: " and then a drop-down menu. Just choose the map in the drop-down menu, and you should get

[ccp4bb] saving coordinates with respect to map in ChimeraX

2021-06-28 Thread khaja faisal tarique
Hello everyone While doing rigid body fit we know that after placing the coordinate to its correct position we can save it with respect to the map. Does anyone know if a similar feature exists in ChimeraX ? Is there a way where the coordinates .pdb/cif file can be saved with respect to its map