[buster-discuss] Difference in R-factors by Buster and DCC

[Ian Tickle]

Dear Italo

I believe this thread answers your question:

http://www.globalphasing.com/pipermail/buster-discuss/2012-June/000157.html

Cheers

-- Ian



On Wed, 1 Apr 2020, 16:33 Ítalo Augusto Cavini, <italo.cavini at usp.br> wrote:

> Dear all,
>
> I am in the deposition process and I am having considerable differences in
> R-factors calculated by DCC compared with Buster values. For one structure
> processed at 1.35 A, in Buster we have R=0.224 and Rfree=0.248 but in the
> validation report DCC gives R=0.233 Rfree=0.263. And the same does not
> happen for structures refined with other refinement tools, Phenix.refine
> for example.
>
> By the way, I am using wwPDB OneDep System and PDB_Extract for validation
> and I am going straight from Buster output to wwPDB OneDep (no model
> changes).
>
> Has anyone ever experienced something similar?
> Any insights about how solving this problem are appreciated.
>
> Stay safe,
> Italo Cavini
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> buster-discuss at globalphasing.com
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