Data quality metrics extracted from 8w3y.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": "ebbc8bae60eaf17a04c9e2aa4efa6525",
  "space_group_name": "P 31 2 1",
  "unit_cell": {
    "a": 61.293,
    "b": 61.293,
    "c": 119.431,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.97946],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.51,1.45],
    "number_observations": 558299,
    "number_observations_unique": 46164,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.112
      },
      {
        "type": "R(meas)",
        "value": 0.117
      },
      {
        "type": "R(pim)",
        "value": 0.033
      },
      {
        "type": "I/SigI",
        "value": 13.5
      },
      {
        "type": "Completeness",
        "value": 98.4
      },
      {
        "type": "Redundancy",
        "value": 12.1
      },
      {
        "type": "CC(1/2)",
        "value": 1.000
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.47,1.45],
      "number_observations": 23811,
      "number_observations_unique": 2184,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 6.103
        },
        {
          "type": "R(meas)",
          "value": 6.398
        },
        {
          "type": "R(pim)",
          "value": 1.871
        },
        {
          "type": "I/SigI",
          "value": 0.4
        },
        {
          "type": "Redundancy",
          "value": 10.9
        },
        {
          "type": "CC(1/2)",
          "value": 0.166
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell
Low resolution limit [Å] 48.510 1.470
High resolution limit [Å] 1.450 1.450
R(merge) 0.1120 6.1030
R(meas) 0.1170 6.3980
R(pim) 0.0330 1.8710
CC(1/2) 1.000 0.166
Completeness [%] 98.4 -
Multiplicity 12.1 10.9


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

Resolution [Å] R(merge) R(meas) R(pim) CC(1/2) Multiplicity
1.470-1.450 6.1030 6.3980 1.8710 0.166 10.9