Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a9cde29db564125d3a8b74d9c1245e52",
"space_group_name": "P 62 2 2",
"unit_cell": {
"a": 96.400,
"b": 96.400,
"c": 205.596,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.93,2.10],
"number_observations_unique": 33838,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.229
},
{
"type": "R(meas)",
"value": 0.232
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 17.9
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 42.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.16,2.10],
"number_observations": 82554,
"number_observations_unique": 2690,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.930
},
{
"type": "R(meas)",
"value": 1.963
},
{
"type": "R(pim)",
"value": 0.354
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Redundancy",
"value": 30.7
},
{
"type": "CC(1/2)",
"value": 0.789
}
]
}
]
}