Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3b7dcd3cd684d8fcc490b047b672a5c8",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 82.100,
"b": 58.004,
"c": 75.928,
"alpha": 90.00,
"beta": 121.55,
"gamma": 90.00
},
"wavelengths": [0.97373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.67],
"number_observations_unique": 35134,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.131
},
{
"type": "I/SigI",
"value": 19.6
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.70,1.67],
"number_observations_unique": 35134,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.01
},
{
"type": "Completeness",
"value": 93.8
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.605
}
]
}
]
}