Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "509e904abe7a1badee339645efc4610a",
"space_group_name": "P 1",
"unit_cell": {
"a": 52.371,
"b": 57.583,
"c": 69.579,
"alpha": 89.74,
"beta": 82.30,
"gamma": 67.53
},
"wavelengths": [0.97948],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.30,2.045],
"number_observations_unique": 45670,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 14.8
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.10,2.05],
"number_observations_unique": 3200,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.381
},
{
"type": "R(meas)",
"value": 0.467
},
{
"type": "R(pim)",
"value": 0.267
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "Completeness",
"value": 88.3
},
{
"type": "Redundancy",
"value": 2.6
},
{
"type": "CC(1/2)",
"value": 0.843
}
]
}
]
}