Data quality metrics extracted from 7jxw.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": "e5f2013e2875d211632ee4316bd3323c",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 170.248,
    "b": 73.059,
    "c": 119.068,
    "alpha": 90.00,
    "beta": 118.57,
    "gamma": 90.00
  },
  "wavelengths": [0.97920],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [65.640,2.500],
    "number_observations": 301319,
    "number_observations_unique": 44233,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.294
      },
      {
        "type": "R(pim)",
        "value": 0.112
      },
      {
        "type": "I/SigI",
        "value": 4.500
      },
      {
        "type": "Completeness",
        "value": 98.900
      },
      {
        "type": "Redundancy",
        "value": 6.800
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.540,2.500],
      "number_observations": 14474,
      "number_observations_unique": 2187,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 2.092
        },
        {
          "type": "R(pim)",
          "value": 0.795
        },
        {
          "type": "I/SigI",
          "value": 0.600
        },
        {
          "type": "Completeness",
          "value": 99.300
        },
        {
          "type": "Redundancy",
          "value": 6.600
        }
      ]
    },
    {
      "resolution_limits": [65.660,6.780],
      "number_observations": 14959,
      "number_observations_unique": 2306,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.114
        },
        {
          "type": "R(pim)",
          "value": 0.045
        },
        {
          "type": "I/SigI",
          "value": 14.400
        },
        {
          "type": "Completeness",
          "value": 98.600
        },
        {
          "type": "Redundancy",
          "value": 6.500
        }
      ]
    }
  ]

}
  

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


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