Data quality metrics extracted from 9vy3.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": "51fab8117e0344c00c3e7b6ab7c49c32",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 70.704,
    "b": 70.843,
    "c": 130.412,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [39.72,2.08],
    "number_observations_unique": 40085,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.168
      },
      {
        "type": "R(meas)",
        "value": 0.176
      },
      {
        "type": "R(pim)",
        "value": 0.050
      },
      {
        "type": "I/SigI",
        "value": 9.88
      },
      {
        "type": "Completeness",
        "value": 99.71
      },
      {
        "type": "Redundancy",
        "value": 12.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.958
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [39.72,7.88],
      "number_observations_unique": 701,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.033
        }
      ]
    },
    {
      "resolution_limits": [7.88,5.82],
      "number_observations_unique": 1176,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.025
        }
      ]
    },
    {
      "resolution_limits": [5.82,4.82],
      "number_observations_unique": 1519,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.028
        }
      ]
    },
    {
      "resolution_limits": [4.82,4.16],
      "number_observations_unique": 1726,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.026
        }
      ]
    },
    {
      "resolution_limits": [4.16,3.76],
      "number_observations_unique": 1967,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.037
        }
      ]
    },
    {
      "resolution_limits": [3.76,3.42],
      "number_observations_unique": 2164,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.041
        }
      ]
    },
    {
      "resolution_limits": [3.42,3.18],
      "number_observations_unique": 2347,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.042
        }
      ]
    },
    {
      "resolution_limits": [3.18,2.96],
      "number_observations_unique": 2467,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.051
        }
      ]
    },
    {
      "resolution_limits": [2.96,2.80],
      "number_observations_unique": 2666,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.055
        }
      ]
    },
    {
      "resolution_limits": [2.80,2.65],
      "number_observations_unique": 2808,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.072
        }
      ]
    },
    {
      "resolution_limits": [2.65,2.53],
      "number_observations_unique": 2910,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.087
        }
      ]
    },
    {
      "resolution_limits": [2.53,2.43],
      "number_observations_unique": 3081,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.113
        }
      ]
    },
    {
      "resolution_limits": [2.43,2.33],
      "number_observations_unique": 3171,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.139
        }
      ]
    },
    {
      "resolution_limits": [2.33,2.25],
      "number_observations_unique": 3330,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.223
        }
      ]
    },
    {
      "resolution_limits": [2.25,2.17],
      "number_observations_unique": 3414,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.245
        }
      ]
    },
    {
      "resolution_limits": [2.17,2.10],
      "number_observations_unique": 3554,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.271
        }
      ]
    }
  ]

}
  

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


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