Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "bf8a9d5c3d8b8cee26fa765f2442071b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.774,
"b": 79.249,
"c": 72.512,
"alpha": 90.00,
"beta": 90.27,
"gamma": 90.00
},
"wavelengths": [0.97623],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.67,2.01],
"number_observations_unique": 33445,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 17.0
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.06,2.01],
"number_observations_unique": 2250,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.657
},
{
"type": "R(meas)",
"value": 0.742
},
{
"type": "R(pim)",
"value": 0.337
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.724
}
]
}
]
}