Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3db83ba1b275498a985d9b2f7a3cfc9b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.463,
"b": 53.027,
"c": 44.462,
"alpha": 90.00,
"beta": 103.14,
"gamma": 90.00
},
"wavelengths": [0.91267],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.78,1.40],
"number_observations": 143992,
"number_observations_unique": 47803,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 94.5
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.40],
"number_observations": 4708,
"number_observations_unique": 2075,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.063
},
{
"type": "R(meas)",
"value": 1.373
},
{
"type": "R(pim)",
"value": 0.854
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 2.3
},
{
"type": "CC(1/2)",
"value": 0.323
}
]
}
]
}