Data quality metrics extracted from 6sy1.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": "7cbe2bdbc6a152bacb5969633a533566",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 78.55,
    "b": 81.22,
    "c": 86.90,
    "alpha": 63.43,
    "beta": 76.96,
    "gamma": 72.06
  },
  "wavelengths": [0.97620],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.010,1.870],
    "number_observations": 254605,
    "number_observations_unique": 145107,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.144
      },
      {
        "type": "R(pim)",
        "value": 0.102
      },
      {
        "type": "I/SigI",
        "value": 5.000
      },
      {
        "type": "Completeness",
        "value": 96.600
      },
      {
        "type": "Redundancy",
        "value": 1.800
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.900,1.870],
      "number_observations": 10286,
      "number_observations_unique": 6864,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.672
        },
        {
          "type": "R(pim)",
          "value": 0.475
        },
        {
          "type": "I/SigI",
          "value": 0.900
        },
        {
          "type": "Completeness",
          "value": 91.300
        },
        {
          "type": "Redundancy",
          "value": 1.500
        }
      ]
    },
    {
      "resolution_limits": [46.020,5.070],
      "number_observations": 13210,
      "number_observations_unique": 7441,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.063
        },
        {
          "type": "R(pim)",
          "value": 0.045
        },
        {
          "type": "I/SigI",
          "value": 13.500
        },
        {
          "type": "Completeness",
          "value": 98.900
        },
        {
          "type": "Redundancy",
          "value": 1.800
        }
      ]
    }
  ]

}
  

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


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