Hello, do you have any negative difference density for the current position of 
the His side chain? If so, it may be in two confirmations. Just a thought.

Best wishes, Jon Cooper, E-mail: jon.b.coo...@protonmail.com

-------- Original Message --------
On 20 Jul 2020, 17:16, samer halabi wrote:

> Hello all,
> I have few blobs in an MHC II structure I am working on, especially opposite 
> to Histidine as in the accompanying screenshot, that I am confused about.
>
> In the crystal conditions, I have Tris, Imidazole, Acetate, PEG and Glycerol.
> Whatever ligand I am fitting in I am getting a clash (overlap -1.029), which 
> makes me think whether there is a covalent bond forming between Histidine and 
> other molecule. Perhaps by oxidation.
>
> I would greatly appreciate if you can advice me about it, whether there is 
> some kind of ligand I can try to fit and if this is something that occurs in 
> some structures.
> Thank you.
> Best regards,
> Samer
>
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