Hello, yes, I tangled with this about a year ago so my memory is a bit vague. I
think you can get the mean protein B-factor from the refmac log file, but for
ligands, etc, I had to write a script. I can dig it out this evening if that's
any use.
Best wishes, Jon Cooper
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bb] Mean B factors and number of atoms (Refmac/baverage)
Hi all,
I’m writing a Table 1 and getting a bit confused when it comes to number of
atoms and average B factors. Refmac has these in the table in the GUI, but the
atom numbers in that table seem to include H, and I’m only interested in non-H
at
bject: [ccp4bb] Mean B factors and number of atoms (Refmac/baverage)
Hi all,
I’m writing a Table 1 and getting a bit confused when it comes to number of
atoms and average B factors. Refmac has these in the table in the GUI, but the
atom numbers in that table seem to include H, and I’m only intere
Hi all,
I’m writing a Table 1 and getting a bit confused when it comes to number of
atoms and average B factors. Refmac has these in the table in the GUI, but the
atom numbers in that table seem to include H, and I’m only interested in non-H
atoms.
As an example, the PDB file says:
REMARK 3
