Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "c29ba159f269cf7291965efdf36af7e0",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 86.518,
"b": 86.518,
"c": 193.041,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.82,2.72],
"number_observations": 466916,
"number_observations_unique": 23234,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(meas)",
"value": 0.143
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 18.8
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 20.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.79,2.72],
"number_observations": 36084,
"number_observations_unique": 1690,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.084
},
{
"type": "R(meas)",
"value": 2.134
},
{
"type": "R(pim)",
"value": 0.460
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 21.4
},
{
"type": "CC(1/2)",
"value": 0.899
}
]
}
]
}