Data quality metrics extracted from 5mc3.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": "a68c38026096bb92f9e7eb38df5af358",
  "space_group_name": "C 2 2 21",
  "unit_cell": {
    "a": 103.590,
    "b": 106.412,
    "c": 217.434,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.91840],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [47.790,1.518],
    "number_observations_unique": 183636,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.08400
      },
      {
        "type": "I/SigI",
        "value": 12.8600
      },
      {
        "type": "Completeness",
        "value": 99.7
      },
      {
        "type": "Redundancy",
        "value": 6.750
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.61,1.52],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.76400
        },
        {
          "type": "I/SigI",
          "value": 1.820
        },
        {
          "type": "Completeness",
          "value": 98.3
        },
        {
          "type": "Redundancy",
          "value": 5.56
        }
      ]
    }
  ]

}
  

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


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