Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "94ed948d6d69610051b4a4ee9584bd97",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 178.49,
"b": 114.88,
"c": 179.82,
"alpha": 90.00,
"beta": 93.21,
"gamma": 90.00
},
"wavelengths": [0.97740],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.44,2.65],
"number_observations_unique": 104923,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.07325
},
{
"type": "R(meas)",
"value": 0.08687
},
{
"type": "R(pim)",
"value": 0.04633
},
{
"type": "I/SigI",
"value": 13.10
},
{
"type": "Completeness",
"value": 99.55
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.745,2.65],
"number_observations_unique": 10236,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.8652
},
{
"type": "R(meas)",
"value": 1.031
},
{
"type": "R(pim)",
"value": 0.5555
},
{
"type": "I/SigI",
"value": 1.25
},
{
"type": "Completeness",
"value": 97.90
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.631
}
]
}
]
}