Data Category exptl

General

Category name
exptl
Required in PDB entries
No
Category group membership
exptl_group
Used in current PDB entries
Yes, in about 100.0 % of entries

Category Relationship Diagrams

70
View full category relationship diagram including all dictionary data categories
70
View abbreviated category relationship diagram including only those categories used in current PDB entries.

Category Description

 

Additional Descriptive Information for Depositors

  
Enter the number of crystals used to collect data that were used 
in the refinement of the deposited coordinates.

Category Example

 
    _exptl.entry_id                    datablock1
    _exptl.absorpt_coefficient_mu      1.22
    _exptl.absorpt_correction_T_max    0.896
    _exptl.absorpt_correction_T_min    0.802
    _exptl.absorpt_correction_type     integration      
    _exptl.absorpt_process_details     
    ;
     Gaussian grid method from SHELX76
     Sheldrick, G. M., "SHELX-76: structure determination and 
     refinement program", Cambridge University, UK, 1976
    ;
    _exptl.crystals_number             1
    _exptl.details                
    ;
     Enraf-Nonius LT2 liquid nitrogen variable-temperature device used
    ;
    _exptl.method                 'single-crystal x-ray diffraction'
    _exptl.method_details              
    ;
     graphite monochromatized Cu K(alpha) fixed tube and 
     Enraf-Nonius CAD4 diffractometer used
    ;

Additional Category Example for Depositors

 
    _exptl.crystals_number             1
    _exptl.method                      'single-crystal x-ray diffraction'