Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "98c47b55a88f43c577fbbb056082a6da",
"space_group_name": "I 4",
"unit_cell": {
"a": 94.912,
"b": 94.912,
"c": 114.097,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [72.97,2.21],
"number_observations": 313052,
"number_observations_unique": 25443,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.319
},
{
"type": "R(meas)",
"value": 0.332
},
{
"type": "R(pim)",
"value": 0.094
},
{
"type": "I/SigI",
"value": 7.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 12.3
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.32,2.21],
"number_observations": 46188,
"number_observations_unique": 3711,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.399
},
{
"type": "R(meas)",
"value": 4.587
},
{
"type": "R(pim)",
"value": 1.292
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Redundancy",
"value": 12.4
},
{
"type": "CC(1/2)",
"value": 0.397
}
]
}
]
}