Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2857d971475691ee9d268c6cb6d9e713",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 91.299,
"b": 91.299,
"c": 124.670,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.660,1.660],
"number_observations": 310788,
"number_observations_unique": 62144,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 6.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.690,1.660],
"number_observations": 15858,
"number_observations_unique": 3039,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.802
},
{
"type": "R(pim)",
"value": 0.381
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.286
}
]
},
{
"resolution_limits": [73.660,9.120],
"number_observations": 2258,
"number_observations_unique": 466,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 20.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
}
]
}