Data quality metrics extracted from 8c4m.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": "e55c83fc675698a86b674950eb1e4141",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 42.14,
    "b": 64.52,
    "c": 129.55,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97702],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.0,1.51],
    "number_observations_unique": 56384,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.051
      },
      {
        "type": "R(meas)",
        "value": 0.053
      },
      {
        "type": "I/SigI",
        "value": 20.41
      },
      {
        "type": "Completeness",
        "value": 99.9
      },
      {
        "type": "Redundancy",
        "value": 8
      },
      {
        "type": "CC(1/2)",
        "value": 1.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.57,1.51],
      "number_observations_unique": 5625,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 3.986
        },
        {
          "type": "R(meas)",
          "value": 4.141
        },
        {
          "type": "CC(1/2)",
          "value": 0.662
        }
      ]
    },
    {
      "resolution_limits": [1.62,1.57],
      "number_observations_unique": 4902,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.66
        },
        {
          "type": "R(meas)",
          "value": 2.763
        },
        {
          "type": "CC(1/2)",
          "value": 0.787
        }
      ]
    },
    {
      "resolution_limits": [1.73,1.62],
      "number_observations_unique": 8040,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.73
        },
        {
          "type": "R(meas)",
          "value": 1.798
        },
        {
          "type": "CC(1/2)",
          "value": 0.8759999999999999
        }
      ]
    },
    {
      "resolution_limits": [8.0,1.73],
      "number_observations_unique": 37356,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.043
        },
        {
          "type": "R(meas)",
          "value": 0.044000000000000004
        },
        {
          "type": "CC(1/2)",
          "value": 1.0
        }
      ]
    },
    {
      "resolution_limits": [14.0,8.00],
      "number_observations_unique": 364,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.02
        },
        {
          "type": "R(meas)",
          "value": 0.021
        },
        {
          "type": "CC(1/2)",
          "value": 1.0
        }
      ]
    },
    {
      "resolution_limits": [17.0,14.00],
      "number_observations_unique": 39,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.027999999999999997
        },
        {
          "type": "R(meas)",
          "value": 0.03
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [50.0,17.00],
      "number_observations_unique": 58,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.025
        },
        {
          "type": "R(meas)",
          "value": 0.027000000000000003
        },
        {
          "type": "CC(1/2)",
          "value": 1.0
        }
      ]
    }
  ]

}
  

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


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