Data quality metrics extracted from 5b7z.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": "e47fb71fc8c3b5ff5f702d4f387b2136",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 50.225,
    "b": 55.220,
    "c": 58.693,
    "alpha": 107.16,
    "beta": 102.23,
    "gamma": 92.35
  },
  "wavelengths": [0.97960],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,1.5],
    "number_observations_unique": 90302,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 13.27
      },
      {
        "type": "Completeness",
        "value": 96
      },
      {
        "type": "Redundancy",
        "value": 3.5
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.53,1.50],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 3.13
        },
        {
          "type": "Completeness",
          "value": 92.8
        },
        {
          "type": "Redundancy",
          "value": 3.3
        }
      ]
    }
  ]

}
  

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


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