Data quality metrics extracted from 6q19.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": "950a3e0af0c8050c0469f9eb97e10d5b",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 47.77,
    "b": 70.03,
    "c": 65.65,
    "alpha": 90.00,
    "beta": 108.21,
    "gamma": 90.00
  },
  "wavelengths": [0.99980],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.573,1.58],
    "number_observations_unique": 55518,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.06087
      },
      {
        "type": "I/SigI",
        "value": 14.25
      },
      {
        "type": "Completeness",
        "value": 98.55
      },
      {
        "type": "Redundancy",
        "value": 3.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.637,1.58],
      "number_observations_unique": 4982,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.6714
        },
        {
          "type": "Completeness",
          "value": 89.19
        },
        {
          "type": "CC(1/2)",
          "value": 0.517
        }
      ]
    }
  ]

}
  

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


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