Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7b4df035e0c3a236ac25166ce52aa483",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.39,
"b": 90.22,
"c": 52.53,
"alpha": 90.000,
"beta": 111.905,
"gamma": 90.000
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.738,1.535],
"number_observations_unique": 59058,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 15.7
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.562,1.535],
"number_observations_unique": 2944,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.479
},
{
"type": "R(meas)",
"value": 0.670
},
{
"type": "R(pim)",
"value": 0.468
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.728
}
]
}
]
}