Data quality metrics extracted from 6y1r.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": "6448a632a5c952cda8e7294a2a6ff3cc",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 45.469,
    "b": 49.425,
    "c": 81.349,
    "alpha": 91.71,
    "beta": 99.18,
    "gamma": 102.61
  },
  "wavelengths": [1.64940],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [80.130,1.730],
    "number_observations": 433861,
    "number_observations_unique": 63824,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.230
      },
      {
        "type": "R(meas)",
        "value": 0.248
      },
      {
        "type": "R(pim)",
        "value": 0.093
      },
      {
        "type": "I/SigI",
        "value": 8.400
      },
      {
        "type": "Completeness",
        "value": 90.000
      },
      {
        "type": "Redundancy",
        "value": 6.800
      },
      {
        "type": "CC(1/2)",
        "value": 0.988
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.760,1.730],
      "number_observations": 10239,
      "number_observations_unique": 1857,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.658
        },
        {
          "type": "R(meas)",
          "value": 2.924
        },
        {
          "type": "R(pim)",
          "value": 1.183
        },
        {
          "type": "I/SigI",
          "value": 0.800
        },
        {
          "type": "Completeness",
          "value": 47.200
        },
        {
          "type": "Redundancy",
          "value": 5.500
        },
        {
          "type": "CC(1/2)",
          "value": 0.168
        }
      ]
    },
    {
      "resolution_limits": [80.130,8.990],
      "number_observations": 3809,
      "number_observations_unique": 502,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.177
        },
        {
          "type": "R(meas)",
          "value": 0.189
        },
        {
          "type": "R(pim)",
          "value": 0.068
        },
        {
          "type": "I/SigI",
          "value": 23.000
        },
        {
          "type": "Completeness",
          "value": 99.200
        },
        {
          "type": "Redundancy",
          "value": 7.600
        },
        {
          "type": "CC(1/2)",
          "value": 0.986
        }
      ]
    }
  ]

}
  

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


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