Data quality metrics extracted from 8oj3.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": "d17b3d2af4d091a19570cc6a0a718f76",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 300.29,
    "b": 294.06,
    "c": 442.55,
    "alpha": 90.00,
    "beta": 99.77,
    "gamma": 90.00
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [266.82,3.5],
    "number_observations_unique": 929602,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.516
      },
      {
        "type": "R(meas)",
        "value": 0.534
      },
      {
        "type": "R(pim)",
        "value": 0.1389
      },
      {
        "type": "I/SigI",
        "value": 4.86
      },
      {
        "type": "Completeness",
        "value": 97.9
      },
      {
        "type": "Redundancy",
        "value": 14.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.55,3.50],
      "number_observations_unique": 38940,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 3.239
        },
        {
          "type": "R(meas)",
          "value": 3.3560000000000003
        },
        {
          "type": "CC(1/2)",
          "value": 0.09
        }
      ]
    },
    {
      "resolution_limits": [3.6,3.55],
      "number_observations_unique": 36813,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 3.082
        },
        {
          "type": "R(meas)",
          "value": 3.194
        },
        {
          "type": "CC(1/2)",
          "value": 0.095
        }
      ]
    },
    {
      "resolution_limits": [3.65,3.60],
      "number_observations_unique": 34777,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 3.012
        },
        {
          "type": "R(meas)",
          "value": 3.122
        },
        {
          "type": "CC(1/2)",
          "value": 0.099
        }
      ]
    },
    {
      "resolution_limits": [3.7,3.65],
      "number_observations_unique": 32947,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.7430000000000003
        },
        {
          "type": "R(meas)",
          "value": 2.844
        },
        {
          "type": "CC(1/2)",
          "value": 0.132
        }
      ]
    },
    {
      "resolution_limits": [3.75,3.70],
      "number_observations_unique": 31098,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.6239999999999997
        },
        {
          "type": "R(meas)",
          "value": 2.7230000000000003
        },
        {
          "type": "CC(1/2)",
          "value": 0.159
        }
      ]
    },
    {
      "resolution_limits": [3.8,3.75],
      "number_observations_unique": 29249,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.4859999999999998
        },
        {
          "type": "R(meas)",
          "value": 2.5810000000000004
        },
        {
          "type": "CC(1/2)",
          "value": 0.185
        }
      ]
    },
    {
      "resolution_limits": [3.9,3.80],
      "number_observations_unique": 50562,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.237
        },
        {
          "type": "R(meas)",
          "value": 2.323
        },
        {
          "type": "CC(1/2)",
          "value": 0.23199999999999998
        }
      ]
    },
    {
      "resolution_limits": [4.0,3.90],
      "number_observations_unique": 49188,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.0669999999999997
        },
        {
          "type": "R(meas)",
          "value": 2.14
        },
        {
          "type": "CC(1/2)",
          "value": 0.33
        }
      ]
    },
    {
      "resolution_limits": [4.5,4.00],
      "number_observations_unique": 187710,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.536
        },
        {
          "type": "R(meas)",
          "value": 1.589
        },
        {
          "type": "CC(1/2)",
          "value": 0.575
        }
      ]
    },
    {
      "resolution_limits": [5.0,4.50],
      "number_observations_unique": 120046,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.956
        },
        {
          "type": "R(meas)",
          "value": 0.991
        },
        {
          "type": "CC(1/2)",
          "value": 0.823
        }
      ]
    },
    {
      "resolution_limits": [7.0,5.00],
      "number_observations_unique": 201504,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.525
        },
        {
          "type": "R(meas)",
          "value": 0.544
        },
        {
          "type": "CC(1/2)",
          "value": 0.948
        }
      ]
    },
    {
      "resolution_limits": [10.0,7.00],
      "number_observations_unique": 77522,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.196
        },
        {
          "type": "R(meas)",
          "value": 0.203
        },
        {
          "type": "CC(1/2)",
          "value": 0.9940000000000001
        }
      ]
    },
    {
      "resolution_limits": [50.0,10.00],
      "number_observations_unique": 38975,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.067
        },
        {
          "type": "R(meas)",
          "value": 0.069
        },
        {
          "type": "CC(1/2)",
          "value": 0.9990000000000001
        }
      ]
    },
    {
      "resolution_limits": [266.82,50.00],
      "number_observations_unique": 271,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.051
        },
        {
          "type": "R(meas)",
          "value": 0.053
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    }
  ]

}
  

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


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