Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "2236a55995fc4546b23d1c4da96d8817",
"space_group_name": "P 1 2 1",
"unit_cell": {
"a": 86.058,
"b": 59.896,
"c": 138.971,
"alpha": 90.00,
"beta": 90.93,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.74,2.75],
"number_observations": 182838,
"number_observations_unique": 36854,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.258
},
{
"type": "R(meas)",
"value": 0.287
},
{
"type": "R(pim)",
"value": 0.124
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.90,2.75],
"number_observations": 27837,
"number_observations_unique": 5331,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.531
},
{
"type": "R(meas)",
"value": 1.694
},
{
"type": "R(pim)",
"value": 0.719
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.510
}
]
}
]
}