Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "edf5e8a1b85152b8ad8cd93f27b6406b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 69.515,
"b": 73.112,
"c": 77.317,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.209,2.086],
"number_observations_unique": 23612,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 16.9
},
{
"type": "Completeness",
"value": 98.0
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.21,2.09],
"number_observations_unique": 3709,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.375
},
{
"type": "I/SigI",
"value": 4.95
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.910
}
]
}
]
}