Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7d2e64bcfa650b4b35a7c1c3c4c4c8a4",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 154.694,
"b": 42.192,
"c": 42.576,
"alpha": 90.000,
"beta": 97.036,
"gamma": 90.000
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.26,2.05],
"number_observations_unique": 17097,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 13.3
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.11,2.05],
"number_observations_unique": 1325,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.515
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "CC(1/2)",
"value": 0.906
}
]
}
]
}