Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "31aa777676109ebd57949ec41dfe6d9d",
"space_group_name": "P 1",
"unit_cell": {
"a": 42.82,
"b": 51.55,
"c": 51.76,
"alpha": 97.01,
"beta": 105.90,
"gamma": 111.66
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.20,2.21],
"number_observations_unique": 17428,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 15.0
},
{
"type": "Completeness",
"value": 91.2
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.29,2.21],
"number_observations_unique": 1147,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.253
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 64.9
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.896
}
]
}
]
}