Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1d3251bcdd5a0bbfdf4d8ae81ede4ecd",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 68.55,
"b": 68.55,
"c": 103.53,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20,2.05],
"number_observations_unique": 76827,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.228
},
{
"type": "R(meas)",
"value": 0.286
},
{
"type": "R(pim)",
"value": 0.128
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 92.9
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.956
}
]
},
"refln_shells": [
{
"resolution_limits": [2.10,2.05],
"number_observations_unique": 5793,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.766
},
{
"type": "R(meas)",
"value": 0.961
},
{
"type": "I/SigI",
"value": 1.57
},
{
"type": "Completeness",
"value": 93.8
},
{
"type": "CC(1/2)",
"value": 0.359
}
]
}
]
}