Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e2232e0c45c85c0ea64908a7eb4f8698",
"space_group_name": "I 4 2 2",
"unit_cell": {
"a": 55.05,
"b": 55.05,
"c": 107.92,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.93,3.10],
"number_observations": 40000,
"number_observations_unique": 1682,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.213
},
{
"type": "R(meas)",
"value": 0.218
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 16.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 23.8
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [3.15,3.10],
"number_observations": 1929,
"number_observations_unique": 79,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.088
},
{
"type": "R(meas)",
"value": 1.111
},
{
"type": "R(pim)",
"value": 0.223
},
{
"type": "I/SigI",
"value": 4.4
},
{
"type": "Redundancy",
"value": 24.4
},
{
"type": "CC(1/2)",
"value": 0.942
}
]
}
]
}