Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a79506679a2eadc3eedd291774aa8d2e",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 93.876,
"b": 93.876,
"c": 33.033,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.940,2.250],
"number_observations": 86458,
"number_observations_unique": 8151,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(meas)",
"value": 0.154
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 13.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.320,2.250],
"number_observations": 8291,
"number_observations_unique": 733,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.279
},
{
"type": "R(meas)",
"value": 1.339
},
{
"type": "R(pim)",
"value": 0.394
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.300
},
{
"type": "CC(1/2)",
"value": 0.861
}
]
},
{
"resolution_limits": [46.940,9.000],
"number_observations": 1520,
"number_observations_unique": 147,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 46.900
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 10.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}