Deal All,<br>After I tried 9 runs of AutoSol from my MAD data by changing parameters (resolution, heavy atom numbers), I got 9 results, named as: AutoSol_run_1_ to AutoSol_run_9_. I found #9 and #7 have the lowest Rfree, so I want to pick the model from these two runs. <br>
However, when I use "phenix.autobuild after_autosol", the resulting AutoBuild files tell me that the program picked the result from #5 of AutoSol, not the lastest #9. <br><br>Does anyone know how can I specify the exact number of AutoSol to run autobuild? <br>
<br>I also tried this command "phenix.autobuild data=resolve_3.mtz model=overall_best.pdb seq_file=zntb-sd.seq"under the directory of AutoSol_run_9_, but failed with the following word:<br>********************************************************************************<br>
Failed to carry out AutoBuild_build_cycle:<br><br>Initial phenix refinement of AutoBuild_run_2_/TEMP0/NO_LIG_NO_WAT_overall_best_edited.pdb with exptl_fobs_phases_freeR_flags.mtz failed...quitting...<br>See AutoBuild_run_2_/LAST.LOG for more information<br>
Please resolve the R-free flags mismatch.<br>********************************************************************************<br><br>Does anyone know where is wrong?<br><br><br><br>Qun Wan<br>Department of Pharmacology, Case Western Reserve University<br>
10900 Euclid Avenue, Cleveland, OH 44106<br>email: <a href="mailto:qunwan1@gmail.com">qunwan1@gmail.com</a><br>lab phone: 216-368-3337<br>