Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "378dd30b3d95b613fc704ca32f2f13ea",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.007,
"b": 79.477,
"c": 79.876,
"alpha": 90.00,
"beta": 105.62,
"gamma": 90.00
},
"wavelengths": [0.96770],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.31,2.09],
"number_observations": 229897,
"number_observations_unique": 30888,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.142
},
{
"type": "R(meas)",
"value": 0.153
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 94.1
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.15,2.09],
"number_observations_unique": 1779,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.063
},
{
"type": "R(meas)",
"value": 1.0
},
{
"type": "R(pim)",
"value": 0.420
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.518
}
]
}
]
}