Data quality metrics extracted from 7pvn.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": "c8c485ae9eda824ee8cd2a62a6fdd890",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 123.949,
    "b": 113.748,
    "c": 183.537,
    "alpha": 90.000,
    "beta": 96.493,
    "gamma": 90.000
  },
  "wavelengths": [0.97620],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,2.71],
    "number_observations_unique": 49253,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.294
      },
      {
        "type": "R(pim)",
        "value": 0.123
      },
      {
        "type": "I/SigI",
        "value": 6.0
      },
      {
        "type": "Completeness",
        "value": 72.5
      },
      {
        "type": "Redundancy",
        "value": 6.66
      },
      {
        "type": "CC(1/2)",
        "value": 0.9847
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.,2.71],
      "number_observations_unique": 986,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.570
        },
        {
          "type": "R(pim)",
          "value": 1.158
        },
        {
          "type": "I/SigI",
          "value": 0.92
        },
        {
          "type": "Completeness",
          "value": 21.8
        },
        {
          "type": "Redundancy",
          "value": 5.56
        },
        {
          "type": "CC(1/2)",
          "value": 0.1695
        }
      ]
    }
  ]

}
  

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


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