Protein Data Bank exchange dictionary (pdbx) version 1.017

Category PDBX_REFINE

Name:
'pdbx_refine'

Description:

   Data items in the PDBX_REFINE category record details about 
   additional structure refinement parameters which are needed 
   to complete legacy REMARK 3 refinement templates in PDB 
   format files.

Example:

Example 1 - PDB placeholders for refinement program SHELX

 
    _pdbx_refine.entry_id                                 ABC001
    _pdbx_refine.R_factor_all_4sig_cutoff                  0.174
    _pdbx_refine.R_factor_obs_4sig_cutoff                  0.169
    _pdbx_refine.number_reflns_obs_4sig_cutoff              1263
    _pdbx_refine.free_R_factor_4sig_cutoff                 0.216
    _pdbx_refine.free_R_val_test_set_ct_4sig_cutoff          164
    _pdbx_refine.free_R_val_test_set_size_perc_4sig_cutoff  1.29

Category groups:
    inclusive_group
    refine_group
    pdbx_group
Category key:
    _pdbx_refine.entry_id

Mandatory category: no