Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "30f767f459ad1bca4d6f9e9b00a19736",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 27.018,
"b": 50.030,
"c": 33.930,
"alpha": 90.0,
"beta": 110.8,
"gamma": 90.0
},
"wavelengths": [0.77488],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [25.27,1.02],
"number_observations_unique": 34060,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.205
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 6.2
},
{
"type": "Completeness",
"value": 88.0
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [1.078,1.02],
"number_observations_unique": 1703,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.137
},
{
"type": "R(pim)",
"value": 1.427
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 50.5
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.341
}
]
}
]
}