#####################################################################################
#####################################################################################
#####################################################################################
### CCP4 PROGRAM SUITE: Phaser                                              2.5.7 ###
#####################################################################################
User:         jmht
Run time:     Tue May 26 21:09:51 2015
Version:      2.5.7
Release Date: Wed Jan 14 13:55:29 2015

If you use this software please cite:
$TEXT:Reference1: $$ $$
"Phaser Crystallographic Software"
A.J. McCoy, R.W. Grosse-Kunstleve, P.D. Adams, M.D. Winn, L.C. Storoni & R.J. Read
J. Appl. Cryst. (2007). 40, 658-674
PDF

$$




*************************************************************************************
*** Phaser Module: PREPROCESSOR                                             2.5.7 ***
*************************************************************************************



ENTER KEYWORD INPUT FROM FILE OR FROM STANDARD INPUT

$TEXT:Script: $$ Baubles Markup $$
MODE MR_AUTO
HKLIN &
/opt/ample-dev1/examples/ronan_ideal_helix/AMPLE_1/MRBUMP/search_polyala10_mrbump/i &
nput/dihipeghrlr_scaled.mtz
LABIN F=F_06_27_02:18:13:20 SIGF=SIGF_06_27_02:18:13:20
COMPosition PROTein MW 13418.055 NUM 17
ENSEmble autoMR PDBFile &
/opt/ample-dev1/examples/ronan_ideal_helix/AMPLE_1/MRBUMP/search_polyala10_mrbump/d &
ata/loc0_ALL_polyala10/unmod/MODEL_UNMOD_loc0_ALL_polyala10.pdb RMS 0.100 
SEARCH ENSEmble autoMR NUM 17
XYZOUT ON
JOBS 1
PACK CUTOFF 85
SGALTERNATIVE SELECT NONE
ROOT phaser_loc0_ALL_polyala10_UNMOD
KILL TIME 360
END

$$
CPU Time: 0 days 0 hrs 0 mins 0.00 secs (      0.00 secs)
Finished: Tue May 26 21:09:51 2015

*************************************************************************************
*** Phaser Module: READ DATA FROM MTZ FILE                                  2.5.7 ***
*************************************************************************************

   Data read from mtz file:
   /opt/ample-dev1/examples/ronan_ideal_helix/AMPLE_1/MRBUMP/search_polyala10_mrbump/
   input/dihipeghrlr_scaled.mtz
   Space-Group Name (Hall Symbol): P 1 21 1 ( P 2yb)
   Space-Group Number: 4
   Unit Cell:   37.75   77.92   56.38   90.00  102.07   90.00
   Column Labels Selected: F_06_27_02:18:13:20 SIGF_06_27_02:18:13:20
   Resolution on Mtz file:  1.20 55.13
   Resolution Selected:     1.20 45.00
   Number of Reflections in Selected Resolution Range: 93708

CPU Time: 0 days 0 hrs 0 mins 0.05 secs (      0.05 secs)
Finished: Tue May 26 21:09:51 2015

*************************************************************************************
*** Phaser Module: AUTOMATED MOLECULAR REPLACEMENT                          2.5.7 ***
*************************************************************************************


   Steps:
      Cell Content Analysis
      Anisotropy correction
      Translational NCS correction
      Rotation Function
      Translation Function
      Packing
      Refinement
      Final Refinement (if data higher resolution than search resolution)

   Number of search ensembles = 17
   Search Method: FAST
   Input Search Order:
      #1: Ensemble autoMR  
      #2: Ensemble autoMR  
      #3: Ensemble autoMR  
      #4: Ensemble autoMR  
      #5: Ensemble autoMR  
      #6: Ensemble autoMR  
      #7: Ensemble autoMR  
      #8: Ensemble autoMR  
      #9: Ensemble autoMR  
      #10: Ensemble autoMR  
      #11: Ensemble autoMR  
      #12: Ensemble autoMR  
      #13: Ensemble autoMR  
      #14: Ensemble autoMR  
      #15: Ensemble autoMR  
      #16: Ensemble autoMR  
      #17: Ensemble autoMR  

   Automatic (best predicted) search order WILL be used
   One test spacegroup
     P 1 21 1

CPU Time: 0 days 0 hrs 0 mins 0.10 secs (      0.10 secs)
Finished: Tue May 26 21:09:51 2015

*************************************************************************************
*** Phaser Module: CELL CONTENT ANALYSIS                                    2.5.7 ***
*************************************************************************************

   Space-Group Name (Hall Symbol): P 1 21 1 ( P 2yb)
   Space-Group Number: 4
   Unit Cell:   37.75   77.92   56.38   90.00  102.07   90.00
   MW of "average" protein to which Matthews applies: 228107


$TEXT:Warning: $$ Baubles Markup $$
-------------------------------------------------------------------------------------
FATAL RUNTIME ERROR: The composition you have entered has a protein/nucleic acid
content of 346.088%, which is impossible. DECREASE your composition.
-------------------------------------------------------------------------------------
$$


--------------------
EXIT STATUS: FAILURE
--------------------

CPU Time: 0 days 0 hrs 0 mins 0.97 secs (      0.97 secs)
Finished: Tue May 26 21:09:52 2015