Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2de8d2dbf84c39cdce028e65a490265d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.083,
"b": 55.473,
"c": 67.792,
"alpha": 90.00,
"beta": 94.15,
"gamma": 90.00
},
"wavelengths": [1.54060],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.2],
"number_observations_unique": 20793,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "I/SigI",
"value": 18.51
},
{
"type": "Completeness",
"value": 97
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
"refln_shells": [
{
"resolution_limits": [2.24,2.2],
"number_observations_unique": 884,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.406
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 81.4
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.78
}
]
}
]
}