Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "21dd8b91f5c94d3cddc3a976e0292ec7",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 115.335,
"b": 53.680,
"c": 44.625,
"alpha": 90.0,
"beta": 101.1,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.59,1.69],
"number_observations": 85040,
"number_observations_unique": 28558,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 95.2
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.69],
"number_observations": 6333,
"number_observations_unique": 3348,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.239
},
{
"type": "R(meas)",
"value": 0.309
},
{
"type": "R(pim)",
"value": 0.192
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Redundancy",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.933
}
]
}
]
}