Data quality metrics extracted from 7nw1.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": "0a1abfab376637b8a918b3bc0cd387ea",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 47.204,
    "b": 67.421,
    "c": 133.984,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97200],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [33.71,1.95],
    "number_observations_unique": 15162,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.132
      },
      {
        "type": "I/SigI",
        "value": 11.7
      },
      {
        "type": "Completeness",
        "value": 46.5
      },
      {
        "type": "Redundancy",
        "value": 8.3
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.05,1.95],
      "number_observations_unique": 152,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.87
        },
        {
          "type": "Completeness",
          "value": 3.0
        },
        {
          "type": "Redundancy",
          "value": 6.8
        },
        {
          "type": "CC(1/2)",
          "value": 0.478
        }
      ]
    }
  ]

}
  

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


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