Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d208c90ce4d61ba5a64f6cb7781c2aff",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 221.984,
"b": 110.763,
"c": 108.590,
"alpha": 90.00,
"beta": 117.98,
"gamma": 90.00
},
"wavelengths": [0.97624],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [98.04,1.83],
"number_observations_unique": 198119,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.12
},
{
"type": "R(pim)",
"value": 0.10
},
{
"type": "I/SigI",
"value": 6.5
},
{
"type": "Completeness",
"value": 93.8
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.98
}
]
},
"refln_shells": [
{
"resolution_limits": [1.88,1.83],
"number_observations_unique": 14473,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.58
},
{
"type": "R(pim)",
"value": 0.49
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 91.2
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.54
}
]
}
]
}