Data quality metrics extracted from 9p2f.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "2b190c018aa42b19a3df48d5d1520dcb",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 48.015,
    "b": 70.426,
    "c": 115.189,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.86214],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.01,1.15],
    "number_observations_unique": 139022,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.134
      },
      {
        "type": "R(meas)",
        "value": 0.174
      },
      {
        "type": "I/SigI",
        "value": 2.64
      },
      {
        "type": "Completeness",
        "value": 99.90
      },
      {
        "type": "Redundancy",
        "value": 13.08
      },
      {
        "type": "CC(1/2)",
        "value": 0.993
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.22,1.15],
      "number_observations_unique": 17551,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.381
        },
        {
          "type": "R(meas)",
          "value": 3.236
        },
        {
          "type": "CC(1/2)",
          "value": 0.078
        }
      ]
    },
    {
      "resolution_limits": [1.3,1.22],
      "number_observations_unique": 16840,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.753
        },
        {
          "type": "R(meas)",
          "value": 2.326
        },
        {
          "type": "CC(1/2)",
          "value": 0.123
        }
      ]
    },
    {
      "resolution_limits": [1.41,1.30],
      "number_observations_unique": 16698,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.343
        },
        {
          "type": "R(meas)",
          "value": 1.782
        },
        {
          "type": "CC(1/2)",
          "value": 0.192
        }
      ]
    },
    {
      "resolution_limits": [1.54,1.41],
      "number_observations_unique": 15299,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.879
        },
        {
          "type": "R(meas)",
          "value": 1.156
        },
        {
          "type": "CC(1/2)",
          "value": 0.407
        }
      ]
    },
    {
      "resolution_limits": [1.72,1.54],
      "number_observations_unique": 13496,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.518
        },
        {
          "type": "R(meas)",
          "value": 0.676
        },
        {
          "type": "CC(1/2)",
          "value": 0.669
        }
      ]
    },
    {
      "resolution_limits": [1.99,1.72],
      "number_observations_unique": 11572,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.246
        },
        {
          "type": "R(meas)",
          "value": 0.324
        },
        {
          "type": "CC(1/2)",
          "value": 0.909
        }
      ]
    },
    {
      "resolution_limits": [2.44,1.99],
      "number_observations_unique": 9350,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.11
        },
        {
          "type": "R(meas)",
          "value": 0.143
        },
        {
          "type": "CC(1/2)",
          "value": 0.974
        }
      ]
    },
    {
      "resolution_limits": [3.44,2.44],
      "number_observations_unique": 7422,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.067
        },
        {
          "type": "R(meas)",
          "value": 0.085
        },
        {
          "type": "CC(1/2)",
          "value": 0.991
        }
      ]
    },
    {
      "resolution_limits": [48.01,3.44],
      "number_observations_unique": 3846,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.048
        },
        {
          "type": "R(meas)",
          "value": 0.061
        },
        {
          "type": "CC(1/2)",
          "value": 0.993
        }
      ]
    }
  ]

}
  

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


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