Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e2fe53fc238b16c4722594f0afb24c87",
"space_group_name": "P 1",
"unit_cell": {
"a": 46.539,
"b": 47.813,
"c": 50.407,
"alpha": 113.297,
"beta": 90.041,
"gamma": 91.219
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.526,1.007],
"number_observations_unique": 175900,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 5.7
},
{
"type": "Completeness",
"value": 49.5
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.156,1.007],
"number_observations_unique": 5226,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.777
},
{
"type": "R(pim)",
"value": 0.486
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.507
}
]
}
]
}