Data quality metrics extracted from 7s7v.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": "9b79cffe8aa9e7a63564ab8b9f625f9e",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 81.189,
    "b": 86.865,
    "c": 91.830,
    "alpha": 75.72,
    "beta": 85.56,
    "gamma": 85.28
  },
  "wavelengths": [0.98480],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [40.39,2.5],
    "number_observations_unique": 82648,
    "quality_factors": [
      {
        "type": "R(pim)",
        "value": 0.06
      },
      {
        "type": "I/SigI",
        "value": 8.3
      },
      {
        "type": "Completeness",
        "value": 98.7
      },
      {
        "type": "Redundancy",
        "value": 3.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.978
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.5,2.5],
      "number_observations_unique": 4588,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.466
        },
        {
          "type": "I/SigI",
          "value": 1.7
        },
        {
          "type": "Completeness",
          "value": 98.1
        },
        {
          "type": "Redundancy",
          "value": 3.2
        }
      ]
    }
  ]

}
  

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


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