Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e55d3e1381bfd4c0ca5b174d60588347",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 31.82,
"b": 53.50,
"c": 51.93,
"alpha": 90.000,
"beta": 95.464,
"gamma": 90.000
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [26.75,1.583],
"number_observations_unique": 23125,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0634
},
{
"type": "R(meas)",
"value": 0.0764
},
{
"type": "R(pim)",
"value": 0.0421
},
{
"type": "I/SigI",
"value": 10.35
},
{
"type": "Completeness",
"value": 97.06
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.639,1.583],
"number_observations_unique": 2133,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.4653
},
{
"type": "R(meas)",
"value": 0.5676
},
{
"type": "R(pim)",
"value": 0.32
},
{
"type": "I/SigI",
"value": 2.17
},
{
"type": "Completeness",
"value": 91.42
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.756
}
]
}
]
}