Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "3105f9b24a56a4264b305dcc11685101",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.650,
"b": 70.369,
"c": 59.811,
"alpha": 90.00,
"beta": 108.93,
"gamma": 90.00
},
"wavelengths": [0.96863],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.02,1.82],
"number_observations_unique": 30698,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 13.3
},
{
"type": "Completeness",
"value": 96.4
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.86,1.82],
"number_observations": 5619,
"number_observations_unique": 1605,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.260
},
{
"type": "R(meas)",
"value": 0.305
},
{
"type": "R(pim)",
"value": 0.157
},
{
"type": "I/SigI",
"value": 3.7
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.924
}
]
}
]
}