Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "20c3116310198a5f45c7db1958bce8a6",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.936,
"b": 53.420,
"c": 44.302,
"alpha": 90.00,
"beta": 100.81,
"gamma": 90.00
},
"wavelengths": [0.91257],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.96,1.34],
"number_observations": 146333,
"number_observations_unique": 52834,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 90.0
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.36,1.34],
"number_observations": 2321,
"number_observations_unique": 1421,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.875
},
{
"type": "R(meas)",
"value": 1.202
},
{
"type": "R(pim)",
"value": 0.819
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 1.6
},
{
"type": "CC(1/2)",
"value": 0.454
}
]
}
]
}