Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4748b1a897d594a84b1168e3fa606d3d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 126.166,
"b": 108.799,
"c": 75.809,
"alpha": 90.00,
"beta": 109.16,
"gamma": 90.00
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.403,1.522],
"number_observations": 394605,
"number_observations_unique": 119938,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 11.600
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.641,1.522],
"number_observations": 13741,
"number_observations_unique": 5998,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.701
},
{
"type": "R(pim)",
"value": 0.450
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 68.300
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.642
}
]
},
{
"resolution_limits": [48.403,4.449],
"number_observations": 20683,
"number_observations_unique": 5996,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 36.800
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}