Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2fe24d8c0f73ba7f4d2c0f31158f81e3",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.636,
"b": 129.595,
"c": 64.325,
"alpha": 90.0,
"beta": 103.8,
"gamma": 90.0
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.98,2.22],
"number_observations_unique": 42442,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.0448
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.405,2.22],
"number_observations_unique": 9236,
"quality_factors": [
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.50
}
]
}
]
}