Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b7edeba0f8228c4985209bbfecee9ff4",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.966,
"b": 58.879,
"c": 45.925,
"alpha": 90.000,
"beta": 117.593,
"gamma": 90.000
},
"wavelengths": [0.92010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [23.85,2.05],
"number_observations_unique": 12776,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(meas)",
"value": 0.122
},
{
"type": "R(pim)",
"value": 0.06139
},
{
"type": "I/SigI",
"value": 7.43
},
{
"type": "Completeness",
"value": 99.02
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.123,2.05],
"number_observations_unique": 1256,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.4288
},
{
"type": "R(meas)",
"value": 0.4957
},
{
"type": "R(pim)",
"value": 0.2459
},
{
"type": "I/SigI",
"value": 1.92
},
{
"type": "Completeness",
"value": 99.52
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.915
}
]
}
]
}