Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e7ef39c6083f878fef8c16fea810dd3a",
"space_group_name": "P 1",
"unit_cell": {
"a": 72.81,
"b": 90.51,
"c": 128.55,
"alpha": 105.50,
"beta": 94.80,
"gamma": 96.15
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.3],
"number_observations_unique": 125374,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.15
},
{
"type": "I/SigI",
"value": 6.6
},
{
"type": "Completeness",
"value": 90.0
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.36,2.3],
"number_observations_unique": 8292,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.471
},
{
"type": "I/SigI",
"value": 2.7
},
{
"type": "Completeness",
"value": 80.4
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.88
}
]
}
]
}