Data quality metrics extracted from 2j7a.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": "d24ad3b2587b45bf025fbb34523b64b7",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 79.664,
    "b": 258.117,
    "c": 580.742,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.73930],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [53.000,2.300],
    "number_observations_unique": 443656,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.10000
      },
      {
        "type": "I/SigI",
        "value": 8.3000
      },
      {
        "type": "Completeness",
        "value": 83.9
      },
      {
        "type": "Redundancy",
        "value": 2.900
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.42,2.30],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.31000
        },
        {
          "type": "I/SigI",
          "value": 3.100
        },
        {
          "type": "Completeness",
          "value": 67.3
        },
        {
          "type": "Redundancy",
          "value": 2.10
        }
      ]
    }
  ]

}
  

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


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