Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "893960de10fc00597b87e59e89b3905d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 122.044,
"b": 58.303,
"c": 53.769,
"alpha": 90.00,
"beta": 114.73,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.6,1.93],
"number_observations_unique": 25919,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.98,1.93],
"number_observations_unique": 1906,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.459
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.79
}
]
}
]
}