Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "37908baa5c09e91b6ebe7d27de56745a",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 45.232,
"b": 54.588,
"c": 114.991,
"alpha": 90.00,
"beta": 101.17,
"gamma": 90.00
},
"wavelengths": [1.54060],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.41,1.90],
"number_observations_unique": 21813,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 13.39
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"number_observations_unique": 2174,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.498
},
{
"type": "R(pim)",
"value": 0.282
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.762
}
]
}
]
}