Dear Community,
Can you tell me. if we fit some metal in X-ray
structure and its geometry and other properties are satisfied but showing
some higher B-factor. does it validate to put that metal-ligand.ligand. At
one site 2 metals such as K and NA fit, but K shows a higher B-factor, but
other parameters such as geometry and other fit better for K instead of NA.
So, out of the two ligands at the same site which one would be more
favorable to be fit.
--
On Thu, Sep 8, 2022 at 6:35 PM smita yadav <[email protected]> wrote:
>
> Dear Community,
> Can you tell me. if we fit some metal in X-ray
> structure and its geometry and other properties are satisfied but showing
> some higher B-factor. does it validate to put that metal-ligand.ligand. At
> one site 2 metal such as K and NA fits, but K shows higher
> --
> Regards,
> Smita Yadav
> Ph.D SRF
> Regional Centre for biotechnology,
> Haryana-121001.
>
--
Regards,
Smita Yadav
Ph.D SRF
Regional Centre for biotechnology,
Haryana-121001.
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