Data quality metrics extracted from 7ih7.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": "ef467aa19294813bc9bc5672a8871420",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 45.30,
    "b": 72.96,
    "c": 52.60,
    "alpha": 90.00,
    "beta": 109.36,
    "gamma": 90.00
  },
  "wavelengths": [0.91840],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [39.50,1.18],
    "number_observations": 347825,
    "number_observations_unique": 101487,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.086
      },
      {
        "type": "R(meas)",
        "value": 0.102
      },
      {
        "type": "I/SigI",
        "value": 8.92
      },
      {
        "type": "Completeness",
        "value": 95.1
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.25,1.18],
      "number_observations": 52573,
      "number_observations_unique": 15560,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.531
        },
        {
          "type": "R(meas)",
          "value": 1.82
        },
        {
          "type": "I/SigI",
          "value": 0.73
        },
        {
          "type": "CC(1/2)",
          "value": 0.37
        }
      ]
    },
    {
      "resolution_limits": [1.33,1.25],
      "number_observations": 50074,
      "number_observations_unique": 15101,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.13
        },
        {
          "type": "R(meas)",
          "value": 1.347
        },
        {
          "type": "I/SigI",
          "value": 1.01
        },
        {
          "type": "CC(1/2)",
          "value": 0.496
        }
      ]
    },
    {
      "resolution_limits": [1.44,1.33],
      "number_observations": 50830,
      "number_observations_unique": 14412,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.7
        },
        {
          "type": "R(meas)",
          "value": 0.827
        },
        {
          "type": "I/SigI",
          "value": 1.72
        },
        {
          "type": "CC(1/2)",
          "value": 0.71
        }
      ]
    },
    {
      "resolution_limits": [1.58,1.44],
      "number_observations": 45449,
      "number_observations_unique": 13444,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.4
        },
        {
          "type": "R(meas)",
          "value": 0.475
        },
        {
          "type": "I/SigI",
          "value": 3.00
        },
        {
          "type": "CC(1/2)",
          "value": 0.864
        }
      ]
    },
    {
      "resolution_limits": [1.76,1.58],
      "number_observations": 42381,
      "number_observations_unique": 12080,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.222
        },
        {
          "type": "R(meas)",
          "value": 0.262
        },
        {
          "type": "I/SigI",
          "value": 5.52
        },
        {
          "type": "CC(1/2)",
          "value": 0.953
        }
      ]
    },
    {
      "resolution_limits": [2.04,1.76],
      "number_observations": 37871,
      "number_observations_unique": 10766,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.102
        },
        {
          "type": "R(meas)",
          "value": 0.121
        },
        {
          "type": "I/SigI",
          "value": 11.85
        },
        {
          "type": "CC(1/2)",
          "value": 0.99
        }
      ]
    },
    {
      "resolution_limits": [2.49,2.04],
      "number_observations": 29978,
      "number_observations_unique": 9022,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.059
        },
        {
          "type": "R(meas)",
          "value": 0.07
        },
        {
          "type": "I/SigI",
          "value": 20.02
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [3.52,2.49],
      "number_observations": 25207,
      "number_observations_unique": 7153,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.031
        },
        {
          "type": "R(meas)",
          "value": 0.037
        },
        {
          "type": "I/SigI",
          "value": 34.09
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    }
  ]

}
  

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


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