Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6132f71a6fcbd663f9b9bcbe18ae8c86",
"space_group_name": "P 1",
"unit_cell": {
"a": 46.710,
"b": 63.406,
"c": 86.595,
"alpha": 84.488,
"beta": 85.334,
"gamma": 80.604
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.57,1.94],
"number_observations_unique": 62528,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 13.5
},
{
"type": "Completeness",
"value": 87.1
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.98
}
]
},
"refln_shells": [
{
"resolution_limits": [1.98,1.94],
"number_observations_unique": 3078,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.230
},
{
"type": "R(pim)",
"value": 0.151
},
{
"type": "I/SigI",
"value": 5.9
},
{
"type": "Completeness",
"value": 85.2
},
{
"type": "Redundancy",
"value": 2.3
},
{
"type": "CC(1/2)",
"value": 0.921
}
]
}
]
}