Data quality metrics extracted from 2ajc.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": "66c23d9a29930c30f5bccef13aa9f151",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 62.35,
    "b": 118.68,
    "c": 133.68,
    "alpha": 112.76,
    "beta": 95.16,
    "gamma": 90.95
  },
  "wavelengths": [1.05000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [40.00,1.95],
    "number_observations_unique": 247685,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.035
      },
      {
        "type": "Completeness",
        "value": 96.800
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.97,1.95],
      "number_observations": 5999,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.338
        }
      ]
    },
    {
      "resolution_limits": [1.98,1.97],
      "number_observations": 6055,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.303
        }
      ]
    },
    {
      "resolution_limits": [2.00,1.98],
      "number_observations": 6126,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.278
        }
      ]
    },
    {
      "resolution_limits": [2.02,2.00],
      "number_observations": 6072,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.259
        }
      ]
    },
    {
      "resolution_limits": [2.04,2.02],
      "number_observations": 6001,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.239
        }
      ]
    },
    {
      "resolution_limits": [2.06,2.04],
      "number_observations": 6085,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.221
        }
      ]
    },
    {
      "resolution_limits": [2.08,2.06],
      "number_observations": 6135,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.21
        }
      ]
    },
    {
      "resolution_limits": [2.10,2.08],
      "number_observations": 6047,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.189
        }
      ]
    },
    {
      "resolution_limits": [2.12,2.10],
      "number_observations": 6143,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.172
        }
      ]
    },
    {
      "resolution_limits": [2.15,2.12],
      "number_observations": 6116,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.16
        }
      ]
    },
    {
      "resolution_limits": [2.17,2.15],
      "number_observations": 6032,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.143
        }
      ]
    },
    {
      "resolution_limits": [2.20,2.17],
      "number_observations": 6118,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.133
        }
      ]
    },
    {
      "resolution_limits": [2.22,2.20],
      "number_observations": 6213,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.128
        }
      ]
    },
    {
      "resolution_limits": [2.25,2.22],
      "number_observations": 6044,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.124
        }
      ]
    },
    {
      "resolution_limits": [2.28,2.25],
      "number_observations": 6171,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.112
        }
      ]
    },
    {
      "resolution_limits": [2.31,2.28],
      "number_observations": 6210,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.104
        }
      ]
    },
    {
      "resolution_limits": [2.34,2.31],
      "number_observations": 6169,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.1
        }
      ]
    },
    {
      "resolution_limits": [2.38,2.34],
      "number_observations": 6186,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.09
        }
      ]
    },
    {
      "resolution_limits": [2.42,2.38],
      "number_observations": 6266,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.086
        }
      ]
    },
    {
      "resolution_limits": [2.46,2.42],
      "number_observations": 6086,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.085
        }
      ]
    },
    {
      "resolution_limits": [2.50,2.46],
      "number_observations": 6271,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.077
        }
      ]
    },
    {
      "resolution_limits": [2.54,2.50],
      "number_observations": 6177,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.075
        }
      ]
    },
    {
      "resolution_limits": [2.59,2.54],
      "number_observations": 6285,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.068
        }
      ]
    },
    {
      "resolution_limits": [2.65,2.59],
      "number_observations": 6180,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.062
        }
      ]
    },
    {
      "resolution_limits": [2.70,2.65],
      "number_observations": 6253,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.058
        }
      ]
    },
    {
      "resolution_limits": [2.77,2.70],
      "number_observations": 6214,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.052
        }
      ]
    },
    {
      "resolution_limits": [2.84,2.77],
      "number_observations": 6331,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.046
        }
      ]
    },
    {
      "resolution_limits": [2.91,2.84],
      "number_observations": 6169,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.042
        }
      ]
    },
    {
      "resolution_limits": [3.00,2.91],
      "number_observations": 6268,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.038
        }
      ]
    },
    {
      "resolution_limits": [3.10,3.00],
      "number_observations": 6335,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.035
        }
      ]
    },
    {
      "resolution_limits": [3.21,3.10],
      "number_observations": 6200,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.031
        }
      ]
    },
    {
      "resolution_limits": [3.33,3.21],
      "number_observations": 6311,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.028
        }
      ]
    },
    {
      "resolution_limits": [3.49,3.33],
      "number_observations": 6295,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.025
        }
      ]
    },
    {
      "resolution_limits": [3.67,3.49],
      "number_observations": 6241,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.024
        }
      ]
    },
    {
      "resolution_limits": [3.90,3.67],
      "number_observations": 6328,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.022
        }
      ]
    },
    {
      "resolution_limits": [4.20,3.90],
      "number_observations": 6277,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.021
        }
      ]
    },
    {
      "resolution_limits": [4.62,4.20],
      "number_observations": 6276,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.021
        }
      ]
    },
    {
      "resolution_limits": [5.29,4.62],
      "number_observations": 6334,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.021
        }
      ]
    },
    {
      "resolution_limits": [6.66,5.29],
      "number_observations": 6320,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.022
        }
      ]
    },
    {
      "resolution_limits": [40.00,6.66],
      "number_observations": 6346,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.02
        }
      ]
    }
  ]

}
  

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


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