Data quality metrics extracted from 8qh8.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": "7acf2e748e5c288e1d35365bf49d0079",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 42.28,
    "b": 41.30,
    "c": 72.22,
    "alpha": 90.00,
    "beta": 104.37,
    "gamma": 90.00
  },
  "wavelengths": [0.97180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [69.962,0.91],
    "number_observations_unique": 115908,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.059000000000000004
      },
      {
        "type": "R(meas)",
        "value": 0.065
      },
      {
        "type": "I/SigI",
        "value": 11.98
      },
      {
        "type": "Completeness",
        "value": 83.6
      },
      {
        "type": "Redundancy",
        "value": 5.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.9990000000000001
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [0.96,0.91],
      "number_observations_unique": 6669,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.746
        },
        {
          "type": "R(meas)",
          "value": 2.246
        },
        {
          "type": "CC(1/2)",
          "value": 0.14300000000000002
        }
      ]
    },
    {
      "resolution_limits": [1.03,0.96],
      "number_observations_unique": 19638,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.165
        },
        {
          "type": "R(meas)",
          "value": 1.3769999999999998
        },
        {
          "type": "CC(1/2)",
          "value": 0.395
        }
      ]
    },
    {
      "resolution_limits": [1.11,1.03],
      "number_observations_unique": 24541,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.61
        },
        {
          "type": "R(meas)",
          "value": 0.684
        },
        {
          "type": "CC(1/2)",
          "value": 0.807
        }
      ]
    },
    {
      "resolution_limits": [1.22,1.11],
      "number_observations_unique": 22618,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.306
        },
        {
          "type": "R(meas)",
          "value": 0.33899999999999997
        },
        {
          "type": "CC(1/2)",
          "value": 0.9470000000000001
        }
      ]
    },
    {
      "resolution_limits": [1.36,1.22],
      "number_observations_unique": 20480,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.18899999999999997
        },
        {
          "type": "R(meas)",
          "value": 0.207
        },
        {
          "type": "CC(1/2)",
          "value": 0.982
        }
      ]
    },
    {
      "resolution_limits": [1.57,1.36],
      "number_observations_unique": 18122,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.107
        },
        {
          "type": "R(meas)",
          "value": 0.11599999999999999
        },
        {
          "type": "CC(1/2)",
          "value": 0.993
        }
      ]
    },
    {
      "resolution_limits": [1.92,1.57],
      "number_observations_unique": 15310,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.064
        },
        {
          "type": "R(meas)",
          "value": 0.07
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [2.72,1.92],
      "number_observations_unique": 11877,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.046
        },
        {
          "type": "R(meas)",
          "value": 0.05
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [69.962,2.72],
      "number_observations_unique": 6665,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.039
        },
        {
          "type": "R(meas)",
          "value": 0.042
        },
        {
          "type": "CC(1/2)",
          "value": 0.9990000000000001
        }
      ]
    }
  ]

}
  

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


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