Data quality metrics extracted from 8ogn.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": "8bcf8089f1392d9625226bf54ae4db1b",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 118.81,
    "b": 38.97,
    "c": 68.40,
    "alpha": 90.00,
    "beta": 95.49,
    "gamma": 90.00
  },
  "wavelengths": [0.91840],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [42.67,1.29],
    "number_observations_unique": 144476,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.066
      },
      {
        "type": "R(meas)",
        "value": 0.083
      },
      {
        "type": "I/SigI",
        "value": 7.86
      },
      {
        "type": "Completeness",
        "value": 96.0
      },
      {
        "type": "Redundancy",
        "value": 2.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.9990000000000001
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.33,1.30],
      "number_observations_unique": 10523,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.4019999999999997
        },
        {
          "type": "R(meas)",
          "value": 3.0039999999999996
        },
        {
          "type": "CC(1/2)",
          "value": 0.252
        }
      ]
    },
    {
      "resolution_limits": [1.37,1.33],
      "number_observations_unique": 10255,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.353
        },
        {
          "type": "R(meas)",
          "value": 2.963
        },
        {
          "type": "CC(1/2)",
          "value": 0.22899999999999998
        }
      ]
    },
    {
      "resolution_limits": [1.41,1.37],
      "number_observations_unique": 10108,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.6580000000000001
        },
        {
          "type": "R(meas)",
          "value": 2.074
        },
        {
          "type": "CC(1/2)",
          "value": 0.37
        }
      ]
    },
    {
      "resolution_limits": [1.45,1.41],
      "number_observations_unique": 9795,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.355
        },
        {
          "type": "R(meas)",
          "value": 1.6869999999999998
        },
        {
          "type": "CC(1/2)",
          "value": 0.462
        }
      ]
    },
    {
      "resolution_limits": [1.5,1.45],
      "number_observations_unique": 9538,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.042
        },
        {
          "type": "R(meas)",
          "value": 1.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.55
        }
      ]
    },
    {
      "resolution_limits": [1.55,1.50],
      "number_observations_unique": 9278,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.738
        },
        {
          "type": "R(meas)",
          "value": 0.924
        },
        {
          "type": "CC(1/2)",
          "value": 0.69
        }
      ]
    },
    {
      "resolution_limits": [1.61,1.55],
      "number_observations_unique": 8823,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.5539999999999999
        },
        {
          "type": "R(meas)",
          "value": 0.698
        },
        {
          "type": "CC(1/2)",
          "value": 0.7859999999999999
        }
      ]
    },
    {
      "resolution_limits": [1.68,1.61],
      "number_observations_unique": 8526,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.433
        },
        {
          "type": "R(meas)",
          "value": 0.541
        },
        {
          "type": "CC(1/2)",
          "value": 0.88
        }
      ]
    },
    {
      "resolution_limits": [1.75,1.68],
      "number_observations_unique": 8250,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.344
        },
        {
          "type": "R(meas)",
          "value": 0.428
        },
        {
          "type": "CC(1/2)",
          "value": 0.915
        }
      ]
    },
    {
      "resolution_limits": [1.84,1.75],
      "number_observations_unique": 7954,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.259
        },
        {
          "type": "R(meas)",
          "value": 0.322
        },
        {
          "type": "CC(1/2)",
          "value": 0.94
        }
      ]
    },
    {
      "resolution_limits": [1.94,1.84],
      "number_observations_unique": 7613,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.174
        },
        {
          "type": "R(meas)",
          "value": 0.217
        },
        {
          "type": "CC(1/2)",
          "value": 0.971
        }
      ]
    },
    {
      "resolution_limits": [2.06,1.94],
      "number_observations_unique": 6961,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.11199999999999999
        },
        {
          "type": "R(meas)",
          "value": 0.141
        },
        {
          "type": "CC(1/2)",
          "value": 0.986
        }
      ]
    },
    {
      "resolution_limits": [2.2,2.06],
      "number_observations_unique": 6773,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.079
        },
        {
          "type": "R(meas)",
          "value": 0.098
        },
        {
          "type": "CC(1/2)",
          "value": 0.9940000000000001
        }
      ]
    },
    {
      "resolution_limits": [2.37,2.20],
      "number_observations_unique": 6256,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.06
        },
        {
          "type": "R(meas)",
          "value": 0.075
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [2.6,2.37],
      "number_observations_unique": 5801,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.048
        },
        {
          "type": "R(meas)",
          "value": 0.06
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [2.91,2.60],
      "number_observations_unique": 5037,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.04
        },
        {
          "type": "R(meas)",
          "value": 0.051
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [3.36,2.91],
      "number_observations_unique": 4469,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.031
        },
        {
          "type": "R(meas)",
          "value": 0.038
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [4.11,3.36],
      "number_observations_unique": 3893,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.024
        },
        {
          "type": "R(meas)",
          "value": 0.03
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [5.81,4.11],
      "number_observations_unique": 2950,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.023
        },
        {
          "type": "R(meas)",
          "value": 0.027999999999999997
        },
        {
          "type": "CC(1/2)",
          "value": 0.9990000000000001
        }
      ]
    }
  ]

}
  

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


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