Compaq mar345 Checking Parameters, End of Data Collection, Imageroot.SUMMARY, Imageroot.html

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mar345 Program Manual

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The decision about what pixelsize to choose is slightly more difficult. In general, the finest pixelsize of 0.1mm is more efficient and yields slightly better data. On the other hand, scans take about 10% longer time and images are larger in size than those taken at the same diameter but in 0.15mm pixelsize mode. So the decision is some kind of compromise.

Output format:

Use of "mar345" format is strongly suggested. A mar345 file typically requires 70% less disk space than a standard uncompressed image file. All major protein data processing packages support this format.

Collect mode:

Use TIME mode unless on synchrotrons.

For indexing crystals, usually 2 images that differ from each other by a movement in ϕ of 90 degrees gives good results. In the case of very small molecules (i.e. cell axes of about 10 deg.) you may not get enough spots from 2 images only.

5.2 Checking Parameters

Before starting a data collection, mar345 makes a consistency check of the input parameters. In most cases the program will tell you if the input parameters really do not make sense. It checks wether files can be opened, if there is enough disk space, etc.

5.3 Errors and Warnings

In case of computer or scanner problems, warning messages will be printed on standard output and in the log file. Very important messages will also be displayed in a special window. Problems fall into 3 categories: fatal errors, warnings and notifications. See chapter Troubleshooting for more details.

5.4 End of Data Collection

After having finished a data set, mar345 writes a summary into the corresponding data directory. The summary files come in 2 formats:

image_root.SUMMARY

= plain Ascii text file

image_root.html

= Ascii−file with HTML−formatting instructions.

These files should be printed and archived.

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Contents Mar research All Rights Reserved Mar345 Program Manual Version February 24Contents Environment IntroductionComputer Requirements Running mar345 Command LineOutput Files Input FilesMar.lp Basic Concepts and RulesMar.log Mar.spyStarting Up Menu Bar User InterfaceMain Window Windows Submenu Menu BarScanner Status Area Scanner Command Area Editing Data Collection Parameters Directory Scan modeCollect mode ItemDescription TitleOscillations ItemDescription First image noNo. of images Exp. timeWavelength variable Loading and Saving Data Collection Parameters Moving Distance and Phi Stopping Data Collection Starting Data CollectionSingle Scan Shutter TimerHardware Status Getting Help14 X−ray Setup Errors and Warnings Display Window Image DisplayShow/Hide statistics Options SubmenuFiles ColorsNext image Reset colorsDo not/Keep color scales Turn On/Off 3D−plotImage Area Mar345 Program Manual Zoom Buttons Work AreaInformation Areas Load ButtonsRainbow Window TitleColors Window Blue scalesMax MinMessage area Cross−Section WindowNo. of peaks Lower horizontal axis Moved using the right mouse buttonVertical axis Upper horizontal axisStrategies Data CollectionImageroot.html Checking ParametersEnd of Data Collection Imageroot.SUMMARYReason TroubleshootingNo. Description MessageTabel from previous 1101 Appendix Configuration File Calibration Files