Data quality metrics extracted from 8cg2.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": "a3412a8a46468d6e57a3ce971ca2dc41",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 142.744,
    "b": 85.381,
    "c": 111.474,
    "alpha": 90.00,
    "beta": 122.25,
    "gamma": 90.00
  },
  "wavelengths": [0.91840],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [47.14,1.37],
    "number_observations_unique": 236648,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.11
      },
      {
        "type": "R(meas)",
        "value": 0.125
      },
      {
        "type": "I/SigI",
        "value": 8.44
      },
      {
        "type": "Completeness",
        "value": 99.4
      },
      {
        "type": "Redundancy",
        "value": 4.41
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.45,1.37],
      "number_observations_unique": 37607,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.696
        },
        {
          "type": "R(meas)",
          "value": 1.9480000000000002
        },
        {
          "type": "CC(1/2)",
          "value": 0.309
        }
      ]
    },
    {
      "resolution_limits": [1.55,1.45],
      "number_observations_unique": 36002,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.035
        },
        {
          "type": "R(meas)",
          "value": 1.176
        },
        {
          "type": "CC(1/2)",
          "value": 0.5870000000000001
        }
      ]
    },
    {
      "resolution_limits": [1.68,1.55],
      "number_observations_unique": 33363,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.644
        },
        {
          "type": "R(meas)",
          "value": 0.736
        },
        {
          "type": "CC(1/2)",
          "value": 0.7390000000000001
        }
      ]
    },
    {
      "resolution_limits": [1.84,1.68],
      "number_observations_unique": 30883,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.397
        },
        {
          "type": "R(meas)",
          "value": 0.45
        },
        {
          "type": "CC(1/2)",
          "value": 0.897
        }
      ]
    },
    {
      "resolution_limits": [2.05,1.84],
      "number_observations_unique": 27897,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.215
        },
        {
          "type": "R(meas)",
          "value": 0.242
        },
        {
          "type": "CC(1/2)",
          "value": 0.9690000000000001
        }
      ]
    },
    {
      "resolution_limits": [2.37,2.05],
      "number_observations_unique": 24744,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.113
        },
        {
          "type": "R(meas)",
          "value": 0.128
        },
        {
          "type": "CC(1/2)",
          "value": 0.99
        }
      ]
    },
    {
      "resolution_limits": [2.9,2.37],
      "number_observations_unique": 20885,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.069
        },
        {
          "type": "R(meas)",
          "value": 0.078
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [4.09,2.90],
      "number_observations_unique": 16207,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.040999999999999995
        },
        {
          "type": "R(meas)",
          "value": 0.047
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [47.14,4.09],
      "number_observations_unique": 9060,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.032
        },
        {
          "type": "R(meas)",
          "value": 0.036000000000000004
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    }
  ]

}
  

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


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