Data quality metrics extracted from 2ar1.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": "032dda14c17ecebbb977a10ce4c65227",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 31.199,
    "b": 64.607,
    "c": 72.559,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97600],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.00,1.60],
    "number_observations_unique": 18997,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.041
      },
      {
        "type": "I/SigI",
        "value": 10.068
      },
      {
        "type": "Completeness",
        "value": 95.300
      },
      {
        "type": "Redundancy",
        "value": 2.900
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.65,1.60],
      "number_observations": 1558,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.693
        },
        {
          "type": "I/SigI",
          "value": 1.603
        }
      ]
    },
    {
      "resolution_limits": [1.70,1.65],
      "number_observations": 1528,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.55
        },
        {
          "type": "I/SigI",
          "value": 2.000
        }
      ]
    },
    {
      "resolution_limits": [1.76,1.70],
      "number_observations": 1518,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.405
        },
        {
          "type": "I/SigI",
          "value": 2.791
        }
      ]
    },
    {
      "resolution_limits": [1.83,1.76],
      "number_observations": 1564,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.322
        },
        {
          "type": "I/SigI",
          "value": 3.463
        }
      ]
    },
    {
      "resolution_limits": [1.91,1.83],
      "number_observations": 1493,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.229
        },
        {
          "type": "I/SigI",
          "value": 4.771
        }
      ]
    },
    {
      "resolution_limits": [2.02,1.91],
      "number_observations": 1500,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.152
        },
        {
          "type": "I/SigI",
          "value": 6.609
        }
      ]
    },
    {
      "resolution_limits": [2.14,2.02],
      "number_observations": 1533,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.099
        },
        {
          "type": "I/SigI",
          "value": 9.203
        }
      ]
    },
    {
      "resolution_limits": [2.31,2.14],
      "number_observations": 1602,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.077
        },
        {
          "type": "I/SigI",
          "value": 11.466
        }
      ]
    },
    {
      "resolution_limits": [2.54,2.31],
      "number_observations": 1624,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.06
        },
        {
          "type": "I/SigI",
          "value": 13.958
        }
      ]
    },
    {
      "resolution_limits": [2.91,2.54],
      "number_observations": 1654,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.044
        },
        {
          "type": "I/SigI",
          "value": 17.446
        }
      ]
    },
    {
      "resolution_limits": [3.66,2.91],
      "number_observations": 1676,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.03
        },
        {
          "type": "I/SigI",
          "value": 22.918
        }
      ]
    },
    {
      "resolution_limits": [50.00,3.66],
      "number_observations": 1747,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.021
        },
        {
          "type": "I/SigI",
          "value": 31.852
        }
      ]
    }
  ]

}
  

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


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