Data quality metrics extracted from 5l6x.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": "e14fc2fe365194b3b5150a9df91887d8",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 77.023,
    "b": 89.410,
    "c": 68.604,
    "alpha": 90.000,
    "beta": 97.816,
    "gamma": 90.000
  },
  "wavelengths": [1.54180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [19.0,1.995],
    "number_observations": 181113,
    "number_observations_unique": 31283,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.070
      },
      {
        "type": "I/SigI",
        "value": 31.148
      },
      {
        "type": "Completeness",
        "value": 99.040
      },
      {
        "type": "Redundancy",
        "value": 5.790
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.066,1.995],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.187
        }
      ]
    },
    {
      "resolution_limits": [2.149,2.066],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.157
        }
      ]
    },
    {
      "resolution_limits": [2.247,2.149],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.127
        }
      ]
    },
    {
      "resolution_limits": [2.365,2.247],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.113
        }
      ]
    },
    {
      "resolution_limits": [2.513,2.365],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.100
        }
      ]
    },
    {
      "resolution_limits": [2.707,2.513],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.093
        }
      ]
    },
    {
      "resolution_limits": [2.979,2.707],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.082
        }
      ]
    },
    {
      "resolution_limits": [3.408,2.979],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.067
        }
      ]
    },
    {
      "resolution_limits": [4.288,3.408],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.057
        }
      ]
    },
    {
      "resolution_limits": [19.0,4.288],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.052
        }
      ]
    }
  ]

}
  

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


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