Data quality metrics extracted from 3lr2.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.2",
  "uuid": "32268365a91ec8f31ea16cdd2129457e",
  "space_group_name": "P 32 2 1",
  "unit_cell": {
    "a": 68.379,
    "b": 68.379,
    "c": 97.857,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [59.23,1.7],
    "number_observations_unique": 27832,
    "quality_factors": [

    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.744,1.7],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.06
        },
        {
          "type": "I/SigI",
          "value": 8.4
        },
        {
          "type": "Redundancy",
          "value": 5.9
        }
      ]
    }
  ]

}
  

Table 1 generated from MXLIMS-JSON (via JavaScript):


Binned data generated from MXLIMS-JSON (via JavaScript):