Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1e2491dea8d8084d0f546360e2bdc43c",
"space_group_name": "P 42 21 2",
"unit_cell": {
"a": 168.35,
"b": 168.35,
"c": 104.96,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [61.18,2.22],
"number_observations_unique": 73523,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.39
},
{
"type": "R(pim)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 7.8
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 19.2
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.35,2.23],
"number_observations_unique": 10366,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.813
},
{
"type": "R(pim)",
"value": 0.196
},
{
"type": "I/SigI",
"value": 3.2
},
{
"type": "Completeness",
"value": 98
},
{
"type": "Redundancy",
"value": 17.6
},
{
"type": "CC(1/2)",
"value": 0.524
}
]
}
]
}