Data quality metrics extracted from 9p2i.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": "41627c8d0489a2a5dfdc0aa6e5a8de16",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 48.111,
    "b": 70.477,
    "c": 115.686,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.86214],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.11,1.25],
    "number_observations_unique": 109750,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.118
      },
      {
        "type": "R(meas)",
        "value": 0.147
      },
      {
        "type": "I/SigI",
        "value": 3.80
      },
      {
        "type": "Completeness",
        "value": 100
      },
      {
        "type": "Redundancy",
        "value": 13.24
      },
      {
        "type": "CC(1/2)",
        "value": 0.995
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.32,1.25],
      "number_observations_unique": 12579,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.656
        },
        {
          "type": "R(meas)",
          "value": 2.132
        },
        {
          "type": "CC(1/2)",
          "value": 0.108
        }
      ]
    },
    {
      "resolution_limits": [1.42,1.32],
      "number_observations_unique": 11881,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.28
        },
        {
          "type": "R(meas)",
          "value": 1.624
        },
        {
          "type": "CC(1/2)",
          "value": 0.234
        }
      ]
    },
    {
      "resolution_limits": [1.53,1.42],
      "number_observations_unique": 11000,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.864
        },
        {
          "type": "R(meas)",
          "value": 1.09
        },
        {
          "type": "CC(1/2)",
          "value": 0.423
        }
      ]
    },
    {
      "resolution_limits": [1.67,1.53],
      "number_observations_unique": 9900,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.547
        },
        {
          "type": "R(meas)",
          "value": 0.687
        },
        {
          "type": "CC(1/2)",
          "value": 0.663
        }
      ]
    },
    {
      "resolution_limits": [1.87,1.67],
      "number_observations_unique": 8760,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.325
        },
        {
          "type": "R(meas)",
          "value": 0.405
        },
        {
          "type": "CC(1/2)",
          "value": 0.86
        }
      ]
    },
    {
      "resolution_limits": [2.16,1.87],
      "number_observations_unique": 7939,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.15
        },
        {
          "type": "R(meas)",
          "value": 0.188
        },
        {
          "type": "CC(1/2)",
          "value": 0.967
        }
      ]
    },
    {
      "resolution_limits": [2.65,2.16],
      "number_observations_unique": 6701,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.096
        },
        {
          "type": "R(meas)",
          "value": 0.119
        },
        {
          "type": "CC(1/2)",
          "value": 0.983
        }
      ]
    },
    {
      "resolution_limits": [3.73,2.65],
      "number_observations_unique": 5015,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.057
        },
        {
          "type": "R(meas)",
          "value": 0.07
        },
        {
          "type": "CC(1/2)",
          "value": 0.994
        }
      ]
    },
    {
      "resolution_limits": [48.11,3.73],
      "number_observations_unique": 2576,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.042
        },
        {
          "type": "R(meas)",
          "value": 0.051
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    }
  ]

}
  

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


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