Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9a949ee92c83988f216fc04cf9c7dcf9",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 89.199,
"b": 53.393,
"c": 82.220,
"alpha": 90.00,
"beta": 95.42,
"gamma": 90.00
},
"wavelengths": [0.97948],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.140,1.720],
"number_observations": 266180,
"number_observations_unique": 40036,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 23.800
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.720],
"number_observations": 5027,
"number_observations_unique": 1332,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.918
},
{
"type": "R(pim)",
"value": 0.491
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 62.100
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.761
}
]
},
{
"resolution_limits": [39.140,9.090],
"number_observations": 1943,
"number_observations_unique": 295,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 101.000
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}