Data quality metrics extracted from 7q3p.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": "94a3242a8c319460e41ec4cfd4a3884d",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 96.408,
    "b": 87.935,
    "c": 106.093,
    "alpha": 90.000,
    "beta": 114.041,
    "gamma": 90.000
  },
  "wavelengths": [0.97630],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.14,2.097],
    "number_observations_unique": 46871,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 12.42
      },
      {
        "type": "Completeness",
        "value": 98.76
      },
      {
        "type": "Redundancy",
        "value": 7.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.172,2.097],
      "number_observations_unique": 4414,
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 1.09
        },
        {
          "type": "Completeness",
          "value": 93.89
        },
        {
          "type": "Redundancy",
          "value": 6.9
        },
        {
          "type": "CC(1/2)",
          "value": 0.464
        }
      ]
    }
  ]

}
  

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


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