Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5f07b8640817bf5dfd872ce2af1e8bfa",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 153.617,
"b": 96.749,
"c": 93.869,
"alpha": 90.00,
"beta": 124.21,
"gamma": 90.00
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [77.63,2.40],
"number_observations_unique": 43861,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 8.3
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.53,2.40],
"number_observations_unique": 6382,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.257
},
{
"type": "R(pim)",
"value": 0.777
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "CC(1/2)",
"value": 0.506
}
]
}
]
}