Great, thanks!
On Fri, Dec 2, 2022 at 6:44 PM Paul Emsley
wrote:
>
> On 02/12/2022 15:30, John Smith wrote:
>
> Dear all!
> I am using Coot 0.9.8.5 EL (ccp4) and I want to add K/potassium ions
> during model building.
> Adding Na and Cl is straightforward, but if I click on Pointer Atom Type
>
On 02/12/2022 15:30, John Smith wrote:
Dear all!
I am using Coot 0.9.8.5 EL (ccp4) and I want to add K/potassium ions
during model building.
Adding Na and Cl is straightforward, but if I click on Pointer Atom
Type other, enter K and hit OK, then a grey atom is added, but it does
not refine.
John:
I recently (22-Nov) pointed out to Paul Emsley that if one entered potassium
through the popup menu, it places the "K" of potassium in the wrong column of a
PDB file, column 13 rather than column 14. The element is right-justified, so
single letter elements use only column 14, but two
Dear all!
I am using Coot 0.9.8.5 EL (ccp4) and I want to add K/potassium ions during
model building.
Adding Na and Cl is straightforward, but if I click on Pointer Atom Type
other, enter K and hit OK, then a grey atom is added, but it does not
refine.
*Warning: Failed to match the dictionary.*
