Data quality metrics extracted from 9vy7.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": "1eeb4b143303f078850c3c7268c6b32c",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 70.896,
    "b": 40.741,
    "c": 56.416,
    "alpha": 90.000,
    "beta": 112.519,
    "gamma": 90.000
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [52.11,1.19],
    "number_observations_unique": 39396,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.073
      },
      {
        "type": "R(meas)",
        "value": 0.081
      },
      {
        "type": "R(pim)",
        "value": 0.035
      },
      {
        "type": "I/SigI",
        "value": 16.6
      },
      {
        "type": "Completeness",
        "value": 82.4
      },
      {
        "type": "Redundancy",
        "value": 4.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.996
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.26,1.19],
      "number_observations_unique": 2135,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.310
        }
      ]
    },
    {
      "resolution_limits": [1.32,1.26],
      "number_observations_unique": 3847,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.187
        }
      ]
    },
    {
      "resolution_limits": [1.42,1.32],
      "number_observations_unique": 5355,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.114
        }
      ]
    },
    {
      "resolution_limits": [1.54,1.42],
      "number_observations_unique": 5749,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.072
        }
      ]
    },
    {
      "resolution_limits": [1.68,1.54],
      "number_observations_unique": 5279,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.050
        }
      ]
    },
    {
      "resolution_limits": [1.88,1.68],
      "number_observations_unique": 4796,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.038
        }
      ]
    },
    {
      "resolution_limits": [2.14,1.88],
      "number_observations_unique": 4260,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.030
        }
      ]
    },
    {
      "resolution_limits": [2.62,2.14],
      "number_observations_unique": 3586,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.028
        }
      ]
    },
    {
      "resolution_limits": [3.52,2.62],
      "number_observations_unique": 2815,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.028
        }
      ]
    },
    {
      "resolution_limits": [52.11,3.52],
      "number_observations_unique": 1574,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.029
        }
      ]
    }
  ]

}
  

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


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