Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7e4bfdbde048769a56d0cc88c6e5b7b7",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 70.93,
"b": 112.23,
"c": 159.74,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.52,1.59],
"number_observations": 1166101,
"number_observations_unique": 85637,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 20.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.6
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.62,1.59],
"number_observations": 54598,
"number_observations_unique": 4138,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.746
},
{
"type": "R(meas)",
"value": 0.775
},
{
"type": "R(pim)",
"value": 0.208
},
{
"type": "I/SigI",
"value": 3.2
},
{
"type": "Redundancy",
"value": 13.2
},
{
"type": "CC(1/2)",
"value": 0.916
}
]
}
]
}