Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4c2720e8a8615bfb1ea68ed2f85c9be8",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 123.849,
"b": 113.280,
"c": 157.681,
"alpha": 90.00,
"beta": 91.74,
"gamma": 90.00
},
"wavelengths": [0.97850],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.19,2.35],
"number_observations": 322678,
"number_observations_unique": 84776,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "R(meas)",
"value": 0.150
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 7.6
},
{
"type": "Completeness",
"value": 93.7
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.39,2.35],
"number_observations": 17008,
"number_observations_unique": 4290,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.593
},
{
"type": "R(meas)",
"value": 0.685
},
{
"type": "R(pim)",
"value": 0.335
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.777
}
]
}
]
}