Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "62900e9ec6a3de77e9c8081ac7af3dba",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 52.309,
"b": 81.806,
"c": 91.554,
"alpha": 90.00,
"beta": 95.44,
"gamma": 90.00
},
"wavelengths": [1.54060],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.44,1.80],
"number_observations_unique": 33989,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.119
},
{
"type": "R(pim)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 8.78
},
{
"type": "Completeness",
"value": 95.5
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.972
}
]
},
"refln_shells": [
{
"resolution_limits": [1.86,1.80],
"number_observations_unique": 3288,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.740
},
{
"type": "R(pim)",
"value": 0.414
},
{
"type": "I/SigI",
"value": 0.91
},
{
"type": "Completeness",
"value": 92.3
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.342
}
]
}
]
}