Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ce38b839f1e74e2b1ecb34003a75e484",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.05,
"b": 52.52,
"c": 44.45,
"alpha": 90.0,
"beta": 103.0,
"gamma": 90.0
},
"wavelengths": [0.91267],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.59,1.69],
"number_observations": 93752,
"number_observations_unique": 28231,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.73,1.69],
"number_observations": 6716,
"number_observations_unique": 2080,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.797
},
{
"type": "R(meas)",
"value": 2.155
},
{
"type": "R(pim)",
"value": 1.176
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.289
}
]
}
]
}