Data quality metrics extracted from 6yji.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": "0e97b04a85f904d3286753107fe35928",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 96.536,
    "b": 187.821,
    "c": 55.447,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97625],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [53.18,1.64],
    "number_observations_unique": 119235,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1827
      },
      {
        "type": "R(pim)",
        "value": 0.05181
      },
      {
        "type": "I/SigI",
        "value": 6.22
      },
      {
        "type": "Completeness",
        "value": 95.55
      },
      {
        "type": "Redundancy",
        "value": 13.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.996
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.699,1.64],
      "number_observations_unique": 9035,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.547
        },
        {
          "type": "R(pim)",
          "value": 0.5036
        },
        {
          "type": "I/SigI",
          "value": 1.07
        },
        {
          "type": "Completeness",
          "value": 73.16
        },
        {
          "type": "Redundancy",
          "value": 10.1
        },
        {
          "type": "CC(1/2)",
          "value": 0.728
        }
      ]
    }
  ]

}
  

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


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