Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "971688b427b1e9e31fda945222b289c4",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 55.231,
"b": 81.466,
"c": 88.808,
"alpha": 90.00,
"beta": 96.56,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.85,1.80],
"number_observations_unique": 35069,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 26.88
},
{
"type": "Completeness",
"value": 96.8
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.87,1.80],
"number_observations_unique": 3250,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.585
},
{
"type": "R(pim)",
"value": 0.388
},
{
"type": "Completeness",
"value": 89.6
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.524
}
]
}
]
}