Hi Paul,
Does this also update the cif dictionary, or stays the change inside
coot?
Best,
Herman
-----Original Message-----
From: CCP4 bulletin board [mailto:[log in to unmask]] On Behalf Of
Paul Emsley
Sent: Friday, January 27, 2012 10:28 AM
To: [log in to unmask]
Subject: Re: [ccp4bb] Ligand chirality error
On 27/01/12 07:25, Debajyoti Dutta wrote:
>
>
>
> How to check the presence of improper chirality of a fitted ligand.
With Coot, Validate -> Incorrect Chiral Volumes
> Is there any way to get rid of such error.
Extensions -> Modelling -> Invert this Chiral Centre.
Paul.
|