Dear Anna, Something I find useful is to convert the output of XSCALE (unmerged) to MTZ format using pointless (pointless -c xdsin SCALED.XDS hklout sorted.mtz) then to merge the reflections with Scala:
scala hklin sorted.mtz hklout scaled.mtz << eof run 1 all scales constant anomalous on # or off eof This will write out the merging statistics in the usual scala way - very helpful. You also get all the loggraphs etc. Best wishes, Graeme On 5 August 2010 15:07, anna delprato <[email protected]> wrote: > Hello All; > > I've just started using XDS and have scaled three data sets from the same > crystal - unmerged. It was a SAD experiment > > My question is concerning which R values to use as data processing > statistics. I don't find any Rsymm or even Redundancy values in the LP > files. > > I came across an exmple where Rr.i.m / Rmeas was reported but I don't > understand the distinction between these values. > > Thank you in advance. > Anna > >
