Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "caf3e598f1cc19011712c506d7c43dfa",
"space_group_name": "P 1",
"unit_cell": {
"a": 55.342,
"b": 58.029,
"c": 98.725,
"alpha": 87.94,
"beta": 76.09,
"gamma": 72.52
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.154,1.98],
"number_observations_unique": 72569,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 12.6
},
{
"type": "Completeness",
"value": 91.3
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.949
}
]
},
"refln_shells": [
{
"resolution_limits": [2.01,1.98],
"number_observations_unique": 2807,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.230
},
{
"type": "R(pim)",
"value": 0.141
},
{
"type": "I/SigI",
"value": 6.0
},
{
"type": "Completeness",
"value": 70.7
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.977
}
]
}
]
}