Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "92bbd02f1d5b5624cc11301530f71b1f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 104.663,
"b": 42.741,
"c": 175.327,
"alpha": 90.000,
"beta": 95.311,
"gamma": 90.000
},
"wavelengths": [0.98010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.68,2.20],
"number_observations_unique": 78954,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 9.9
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.24,2.20],
"number_observations_unique": 4080,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.514
},
{
"type": "R(meas)",
"value": 0.640
},
{
"type": "R(pim)",
"value": 0.374
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.675
}
]
}
]
}