Data quality metrics extracted from 1uvz.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": "c3ac8a47661d891dcdf3cc55850ac1b4",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 49.038,
    "b": 49.087,
    "c": 78.977,
    "alpha": 87.96,
    "beta": 83.19,
    "gamma": 79.08
  },
  "wavelengths": [0.84410],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [23.500,2.000],
    "number_observations_unique": 47020,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.06000
      },
      {
        "type": "I/SigI",
        "value": 9.7200
      },
      {
        "type": "Completeness",
        "value": 96.9
      },
      {
        "type": "Redundancy",
        "value": 2.110
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.20,2.00],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.22000
        },
        {
          "type": "I/SigI",
          "value": 4.220
        },
        {
          "type": "Completeness",
          "value": 90.4
        },
        {
          "type": "Redundancy",
          "value": 2.00
        }
      ]
    }
  ]

}
  

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


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