Data quality metrics extracted from 6rwv.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": "b7c57e82eb8498118530eb03ae505af6",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 48.303,
    "b": 76.723,
    "c": 52.258,
    "alpha": 90.000,
    "beta": 106.558,
    "gamma": 90.000
  },
  "wavelengths": [0.98000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.0905681247,1.63863795352],
    "number_observations_unique": 44834,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.06407
      },
      {
        "type": "R(meas)",
        "value": 0.09061
      },
      {
        "type": "R(pim)",
        "value": 0.06407
      },
      {
        "type": "I/SigI",
        "value": 6.50
      },
      {
        "type": "Completeness",
        "value": 99.84
      },
      {
        "type": "Redundancy",
        "value": 2.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.698,1.639],
      "number_observations_unique": 4416,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.6822
        },
        {
          "type": "R(meas)",
          "value": 0.9648
        },
        {
          "type": "R(pim)",
          "value": 0.6822
        },
        {
          "type": "I/SigI",
          "value": 1.09
        },
        {
          "type": "Completeness",
          "value": 99.10
        },
        {
          "type": "Redundancy",
          "value": 2.0
        },
        {
          "type": "CC(1/2)",
          "value": 0.435
        }
      ]
    }
  ]

}
  

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


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