Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "44f721d51b96c213b60fa747f8cab98c",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 70.400,
"b": 108.311,
"c": 153.266,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.35,2.8],
"number_observations_unique": 29580,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.697
},
{
"type": "I/SigI",
"value": 27.87
},
{
"type": "Completeness",
"value": 89.48
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.866
}
]
},
"refln_shells": [
{
"resolution_limits": [2.9,2.8],
"number_observations_unique": 2773,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.605
},
{
"type": "I/SigI",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.518
}
]
}
]
}