Hi Sebastiano, If they hand you an *unmerged* mtz file containing scaled data you can do this, by remerging the data with Scala or Aimless. Equivalently the unmerged output of scalepack or XSCALE (or XDS CORRECT)
If however you have merged data then you have lost this information, though completeness and Mn(I/sig) are available, but not Rsym / Rpim / multiplicity etc. Unmerged files are good :o) Cheerio, Graeme On 17 January 2013 09:18, Sebastiano Pasqualato <sebastiano.pasqual...@gmail.com> wrote: > > Hi all, > maybe a silly question, but I can't figure this out. > > Is there a piece of software to calculate "Table I statistics" such as Rsym, > Mn(I/sigI), Multiplicity, Completeness, from a structure factors file > already containing merged structure factors? > > That is, if somebody hands me an mtz file he used to solve a structure, how > can I determine the overall quality of the collected data, without having > access to the processing logs? > > Thanks in advance, > ciao, > Sebastiano > > -- > Sebastiano Pasqualato, PhD > Crystallography Unit > Department of Experimental Oncology > European Institute of Oncology > IFOM-IEO Campus > via Adamello, 16 > 20139 - Milano > Italy > > tel +39 02 9437 5167 > fax +39 02 9437 5990 > > please note the change in email address! > sebastiano.pasqual...@ieo.eu > > > > > >
