Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6a25cd5fa21aee3306e60976c82da86e",
"space_group_name": "P 1",
"unit_cell": {
"a": 29.230,
"b": 57.512,
"c": 101.094,
"alpha": 93.99,
"beta": 96.08,
"gamma": 107.70
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.02,2.2],
"number_observations_unique": 30520,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.08199
},
{
"type": "R(pim)",
"value": 0.04369
},
{
"type": "I/SigI",
"value": 9.74
},
{
"type": "Completeness",
"value": 96.78
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.279,2.2],
"number_observations_unique": 10728,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.3676
},
{
"type": "R(meas)",
"value": 0.4347
},
{
"type": "R(pim)",
"value": 0.2293
},
{
"type": "I/SigI",
"value": 3.02
},
{
"type": "Completeness",
"value": 95.92
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.925
}
]
}
]
}