Data quality metrics extracted from 7a62.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": "96a27b2aa4509de5d1a7df4339c9c957",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 80.96,
    "b": 117.95,
    "c": 216.41,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97900],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.18,2.438],
    "number_observations_unique": 77982,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1677
      },
      {
        "type": "R(meas)",
        "value": 0.1742
      },
      {
        "type": "I/SigI",
        "value": 8.81
      },
      {
        "type": "Completeness",
        "value": 84
      },
      {
        "type": "Redundancy",
        "value": 13.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.525,2.438],
      "number_observations_unique": 4879,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.828
        },
        {
          "type": "R(meas)",
          "value": 1.907
        },
        {
          "type": "I/SigI",
          "value": 0.84
        },
        {
          "type": "Completeness",
          "value": 98
        },
        {
          "type": "Redundancy",
          "value": 12.4
        },
        {
          "type": "CC(1/2)",
          "value": 0.753
        }
      ]
    }
  ]

}
  

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


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