Data quality metrics extracted from 6ymq.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": "339e990c2e3589d35504eeeccda18db5",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 167.51,
    "b": 180.77,
    "c": 125.51,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.96880],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [83.75,3.07],
    "number_observations_unique": 71788,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.3059
      },
      {
        "type": "R(pim)",
        "value": 0.119
      },
      {
        "type": "I/SigI",
        "value": 6.83
      },
      {
        "type": "Completeness",
        "value": 99.83
      },
      {
        "type": "Redundancy",
        "value": 6.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.991
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.18,3.07],
      "number_observations_unique": 7077,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 99.9
        },
        {
          "type": "Redundancy",
          "value": 6.6
        },
        {
          "type": "CC(1/2)",
          "value": 0.558
        }
      ]
    }
  ]

}
  

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


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