Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b98b7da7179f426ab9ff58e6a2a30936",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.312,
"b": 53.102,
"c": 45.613,
"alpha": 90.0,
"beta": 103.3,
"gamma": 90.0
},
"wavelengths": [0.99999],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.623,1.959],
"number_observations_unique": 18236,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 94.500
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.993,1.959],
"number_observations_unique": 975,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.989
},
{
"type": "R(pim)",
"value": 0.587
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.517
}
]
}
]
}