Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "84b20beb3f246fbcf08280cad87b89d7",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.803,
"b": 93.729,
"c": 53.143,
"alpha": 90.000,
"beta": 110.339,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.9,1.71],
"number_observations_unique": 36732,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.09
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.74,1.71],
"number_observations_unique": 1909,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.875
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.762
}
]
}
]
}