Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "ab912a0846182aec1f81c11c6b55ec8e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 89.048,
"b": 58.247,
"c": 32.694,
"alpha": 90.00,
"beta": 92.63,
"gamma": 90.00
},
"wavelengths": [0.92204],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.48,1.58],
"number_observations": 158987,
"number_observations_unique": 22498,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 10.2
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.66,1.58],
"number_observations": 21789,
"number_observations_unique": 3228,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.721
},
{
"type": "R(meas)",
"value": 1.866
},
{
"type": "R(pim)",
"value": 0.712
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.484
}
]
}
]
}