Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b717be1f7c79ae8d89cc70333efc524d",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 76.82,
"b": 76.82,
"c": 174.31,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97856],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.77,2.45],
"number_observations_unique": 22619,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0115
},
{
"type": "I/SigI",
"value": 30.8
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 59.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.51,2.45],
"number_observations_unique": 1648,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.897
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.605
}
]
}
]
}