Data quality metrics extracted from 9rxi.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "f96586a088343a05bed90742ff16ee28",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 70.141,
    "b": 181.800,
    "c": 78.854,
    "alpha": 90.00,
    "beta": 92.41,
    "gamma": 90.00
  },
  "wavelengths": [0.77490],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [90.90,2.59],
    "number_observations_unique": 61228,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.699
      },
      {
        "type": "R(pim)",
        "value": 0.194
      },
      {
        "type": "I/SigI",
        "value": 6.7
      },
      {
        "type": "Completeness",
        "value": 100
      },
      {
        "type": "Redundancy",
        "value": 12.1
      },
      {
        "type": "CC(1/2)",
        "value": 1.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.63,2.59],
      "number_observations_unique": 3052,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 7.966
        },
        {
          "type": "R(pim)",
          "value": 2.202
        },
        {
          "type": "I/SigI",
          "value": 1.0
        },
        {
          "type": "Completeness",
          "value": 100
        },
        {
          "type": "Redundancy",
          "value": 12.1
        },
        {
          "type": "CC(1/2)",
          "value": 0.3
        }
      ]
    }
  ]

}
  

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


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