Data quality metrics extracted from 1hdi.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": "99729cbf29bdb48cc816c7aaec183b9e",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 50.5,
    "b": 105.2,
    "c": 35.9,
    "alpha": 90.0,
    "beta": 98.4,
    "gamma": 90.0
  },
  "wavelengths": [1.48800],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20.000,1.800],
    "number_observations_unique": 34292,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.08100
      },
      {
        "type": "I/SigI",
        "value": 17.0000
      },
      {
        "type": "Completeness",
        "value": 95.6
      },
      {
        "type": "Redundancy",
        "value": 2.400
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.88,1.80],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.24400
        },
        {
          "type": "I/SigI",
          "value": 3.000
        },
        {
          "type": "Completeness",
          "value": 98.1
        },
        {
          "type": "Redundancy",
          "value": 2.30
        }
      ]
    }
  ]

}
  

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


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