Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b0942186f34c713f5d3aeac0257e66cd",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 41.38,
"b": 54.52,
"c": 57.50,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.59,1.68],
"number_observations_unique": 15287,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 13.5
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.71,1.68],
"number_observations_unique": 684,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.042
},
{
"type": "R(meas)",
"value": 2.522
},
{
"type": "R(pim)",
"value": 1.452
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Completeness",
"value": 87.8
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.311
}
]
}
]
}