Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "371ca805918b2308c0fdb0edc1a8e661",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 104.219,
"b": 34.955,
"c": 66.450,
"alpha": 90.00,
"beta": 97.05,
"gamma": 90.00
},
"wavelengths": [0.96546],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.72,2.26],
"number_observations": 33732,
"number_observations_unique": 9720,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 13.1
},
{
"type": "Completeness",
"value": 85.1
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.33,2.26],
"number_observations": 1054,
"number_observations_unique": 509,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.584
},
{
"type": "R(meas)",
"value": 0.744
},
{
"type": "R(pim)",
"value": 0.455
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.554
}
]
}
]
}