Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f6f11f7adfcc8d1d4a677b4cf59bbbb8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.915,
"b": 61.270,
"c": 44.246,
"alpha": 90.000,
"beta": 117.077,
"gamma": 90.000
},
"wavelengths": [1.00005],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.14,1.38],
"number_observations_unique": 40742,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.02558
},
{
"type": "R(meas)",
"value": 0.02998
},
{
"type": "R(pim)",
"value": 0.01541
},
{
"type": "I/SigI",
"value": 27.83
},
{
"type": "Completeness",
"value": 96.93
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.429,1.38],
"number_observations_unique": 4022,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2452
},
{
"type": "R(meas)",
"value": 0.2853
},
{
"type": "R(pim)",
"value": 0.1442
},
{
"type": "I/SigI",
"value": 5.25
},
{
"type": "Completeness",
"value": 95.70
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
}
]
}