Data quality metrics extracted from 7ig1.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": "0b6dcc5bb8c4e33473727ca6949e0c92",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 45.31,
    "b": 72.89,
    "c": 52.79,
    "alpha": 90.00,
    "beta": 109.44,
    "gamma": 90.00
  },
  "wavelengths": [0.91840],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [29.41,1.36],
    "number_observations": 233760,
    "number_observations_unique": 65365,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.095
      },
      {
        "type": "R(meas)",
        "value": 0.112
      },
      {
        "type": "I/SigI",
        "value": 8.23
      },
      {
        "type": "Completeness",
        "value": 93.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.44,1.36],
      "number_observations": 36649,
      "number_observations_unique": 10226,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.205
        },
        {
          "type": "R(meas)",
          "value": 1.415
        },
        {
          "type": "I/SigI",
          "value": 1.15
        },
        {
          "type": "CC(1/2)",
          "value": 0.41
        }
      ]
    },
    {
      "resolution_limits": [1.54,1.44],
      "number_observations": 35520,
      "number_observations_unique": 9898,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.766
        },
        {
          "type": "R(meas)",
          "value": 0.898
        },
        {
          "type": "I/SigI",
          "value": 1.83
        },
        {
          "type": "CC(1/2)",
          "value": 0.613
        }
      ]
    },
    {
      "resolution_limits": [1.66,1.54],
      "number_observations": 31651,
      "number_observations_unique": 9049,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.487
        },
        {
          "type": "R(meas)",
          "value": 0.572
        },
        {
          "type": "I/SigI",
          "value": 2.82
        },
        {
          "type": "CC(1/2)",
          "value": 0.797
        }
      ]
    },
    {
      "resolution_limits": [1.82,1.66],
      "number_observations": 32026,
      "number_observations_unique": 8677,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.292
        },
        {
          "type": "R(meas)",
          "value": 0.341
        },
        {
          "type": "I/SigI",
          "value": 4.77
        },
        {
          "type": "CC(1/2)",
          "value": 0.921
        }
      ]
    },
    {
      "resolution_limits": [2.03,1.82],
      "number_observations": 28324,
      "number_observations_unique": 7839,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.152
        },
        {
          "type": "R(meas)",
          "value": 0.178
        },
        {
          "type": "I/SigI",
          "value": 8.34
        },
        {
          "type": "CC(1/2)",
          "value": 0.977
        }
      ]
    },
    {
      "resolution_limits": [2.35,2.03],
      "number_observations": 22383,
      "number_observations_unique": 6651,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.094
        },
        {
          "type": "R(meas)",
          "value": 0.111
        },
        {
          "type": "I/SigI",
          "value": 12.27
        },
        {
          "type": "CC(1/2)",
          "value": 0.989
        }
      ]
    },
    {
      "resolution_limits": [2.87,2.35],
      "number_observations": 21916,
      "number_observations_unique": 5952,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.063
        },
        {
          "type": "R(meas)",
          "value": 0.074
        },
        {
          "type": "I/SigI",
          "value": 17.59
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [4.05,2.87],
      "number_observations": 16047,
      "number_observations_unique": 4552,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.04
        },
        {
          "type": "R(meas)",
          "value": 0.047
        },
        {
          "type": "I/SigI",
          "value": 24.80
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    }
  ]

}
  

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


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