Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1244ccda4b92dd983ace29499520138f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 100.50,
"b": 32.91,
"c": 73.06,
"alpha": 90.000,
"beta": 90.164,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.06,1.15],
"number_observations_unique": 84723,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.15],
"number_observations_unique": 4212,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.699
},
{
"type": "R(pim)",
"value": 0.479
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.738
}
]
}
]
}