Data quality metrics extracted from 9mas.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": "b2b7aa5ce7b305c6f65759eedf8c4235",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 65.642,
    "b": 80.073,
    "c": 80.104,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,1.757],
    "number_observations_unique": 42746,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 22.60
      },
      {
        "type": "Completeness",
        "value": 99.9
      },
      {
        "type": "Redundancy",
        "value": 25.05
      },
      {
        "type": "CC(1/2)",
        "value": 0.9986
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [50.00,7.74],
      "number_observations_unique": 586,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9995
        }
      ]
    },
    {
      "resolution_limits": [7.74,5.52],
      "number_observations_unique": 946,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9987
        }
      ]
    },
    {
      "resolution_limits": [5.52,4.52],
      "number_observations_unique": 1172,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9987
        }
      ]
    },
    {
      "resolution_limits": [4.52,3.92],
      "number_observations_unique": 1394,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9992
        }
      ]
    },
    {
      "resolution_limits": [3.92,3.51],
      "number_observations_unique": 1564,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9988
        }
      ]
    },
    {
      "resolution_limits": [3.51,3.20],
      "number_observations_unique": 1691,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9985
        }
      ]
    },
    {
      "resolution_limits": [3.20,2.97],
      "number_observations_unique": 1820,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9975
        }
      ]
    },
    {
      "resolution_limits": [2.97,2.78],
      "number_observations_unique": 1985,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9965
        }
      ]
    },
    {
      "resolution_limits": [2.78,2.62],
      "number_observations_unique": 2084,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9953
        }
      ]
    },
    {
      "resolution_limits": [2.62,2.48],
      "number_observations_unique": 2229,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9942
        }
      ]
    },
    {
      "resolution_limits": [2.48,2.37],
      "number_observations_unique": 2296,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9926
        }
      ]
    },
    {
      "resolution_limits": [2.37,2.27],
      "number_observations_unique": 2405,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9909
        }
      ]
    },
    {
      "resolution_limits": [2.27,2.18],
      "number_observations_unique": 2524,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9852
        }
      ]
    },
    {
      "resolution_limits": [2.18,2.10],
      "number_observations_unique": 2608,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9879
        }
      ]
    },
    {
      "resolution_limits": [2.10,2.03],
      "number_observations_unique": 2688,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9775
        }
      ]
    },
    {
      "resolution_limits": [2.03,1.96],
      "number_observations_unique": 2784,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9760
        }
      ]
    },
    {
      "resolution_limits": [1.96,1.91],
      "number_observations_unique": 2870,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9636
        }
      ]
    },
    {
      "resolution_limits": [1.91,1.85],
      "number_observations_unique": 2939,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9572
        }
      ]
    },
    {
      "resolution_limits": [1.85,1.80],
      "number_observations_unique": 3046,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9490
        }
      ]
    },
    {
      "resolution_limits": [1.80,1.76],
      "number_observations_unique": 3115,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9211
        }
      ]
    }
  ]

}
  

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


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