[ccp4bb] COOT water retention problem...

2010-11-10 Thread Smith, Myron
Has anyone ever accidentally placed a water molecule onto the exact
position of selected atom and tried to delete it? How was that achieved?
I actually saved the pdb file and deleted the text line of the
coordinates for the offending water, then reloaded the file. Is there
any other procedure that does not require external manipulation of the
file outside of COOT?

 

 

Regards

Myron


Evotec (UK) Ltd is a limited company registered in England and Wales. 
Registration number:2674265. Registered office: 114 Milton Park, Abingdon, 
Oxfordshire, OX14 4SA, United Kingdom.


Re: [ccp4bb] COOT water retention problem...

2010-11-10 Thread Folmer Fredslund
Dear Myron,

What is wrong with using the Delete Item option from the menu?
It's gives you a couple of choices, one of which is waters. Means that
you will only delete waters when selecting in the main window.

That is the way I do it anyway.

Best regards,
Folmer Fredslund


2010/11/10 Smith, Myron myron.sm...@evotec.com:
 Has anyone ever accidentally placed a water molecule onto the exact position
 of selected atom and tried to delete it? How was that achieved? I actually
 saved the pdb file and deleted the text line of the coordinates for the
 offending water, then reloaded the file. Is there any other procedure that
 does not require external manipulation of the file outside of COOT?





 Regards

 Myron

 Evotec (UK) Ltd is a limited company registered in England and Wales.
 Registration number:2674265.  Registered Office:  114 Milton Park, Abingdon,
 Oxfordshire, OX14 4SA, United Kingdom