Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "325d2083a76c914551e5270af4dc8b9f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.429,
"b": 52.805,
"c": 44.379,
"alpha": 90.00,
"beta": 102.91,
"gamma": 90.00
},
"wavelengths": [0.91256],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.75,1.69],
"number_observations": 85993,
"number_observations_unique": 28255,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.111
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 9.1
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.72,1.69],
"number_observations": 3617,
"number_observations_unique": 1406,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.888
},
{
"type": "R(meas)",
"value": 1.102
},
{
"type": "R(pim)",
"value": 0.645
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 2.6
},
{
"type": "CC(1/2)",
"value": 0.423
}
]
}
]
}