Data quality metrics extracted from 8x5v.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": "da306cf936a8bedddd0acd74576f230a",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 144.75,
    "b": 99.21,
    "c": 119.30,
    "alpha": 90.000,
    "beta": 97.087,
    "gamma": 90.000
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [118.389,2],
    "number_observations_unique": 112881,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.25
      },
      {
        "type": "I/SigI",
        "value": 19.01
      },
      {
        "type": "Completeness",
        "value": 99.9
      },
      {
        "type": "Redundancy",
        "value": 28
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.12,2.00],
      "number_observations_unique": 18007,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 4.111
        },
        {
          "type": "R(meas)",
          "value": 4.186
        },
        {
          "type": "CC(1/2)",
          "value": 0.649
        }
      ]
    },
    {
      "resolution_limits": [2.27,2.12],
      "number_observations_unique": 17459,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.646
        },
        {
          "type": "R(meas)",
          "value": 2.694
        },
        {
          "type": "CC(1/2)",
          "value": 0.877
        }
      ]
    },
    {
      "resolution_limits": [2.45,2.27],
      "number_observations_unique": 15743,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.607
        },
        {
          "type": "R(meas)",
          "value": 1.64
        },
        {
          "type": "CC(1/2)",
          "value": 0.951
        }
      ]
    },
    {
      "resolution_limits": [2.68,2.45],
      "number_observations_unique": 14488,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.849
        },
        {
          "type": "R(meas)",
          "value": 0.865
        },
        {
          "type": "CC(1/2)",
          "value": 0.982
        }
      ]
    },
    {
      "resolution_limits": [3.0,2.68],
      "number_observations_unique": 13463,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.418
        },
        {
          "type": "R(meas)",
          "value": 0.425
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [3.46,3.00],
      "number_observations_unique": 11655,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.19
        },
        {
          "type": "R(meas)",
          "value": 0.194
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [4.24,3.46],
      "number_observations_unique": 10011,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.124
        },
        {
          "type": "R(meas)",
          "value": 0.126
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [6.0,4.24],
      "number_observations_unique": 7754,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.096
        },
        {
          "type": "R(meas)",
          "value": 0.098
        },
        {
          "type": "CC(1/2)",
          "value": 1.0
        }
      ]
    },
    {
      "resolution_limits": [50,6.00],
      "number_observations_unique": 4301,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.076
        },
        {
          "type": "R(meas)",
          "value": 0.078
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    }
  ]

}
  

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


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