Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f166e08d5f2e95768f2b118e102de38b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.763,
"b": 79.215,
"c": 55.757,
"alpha": 90.000,
"beta": 111.053,
"gamma": 90.000
},
"wavelengths": [1.03317],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.53],
"number_observations_unique": 52325,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.04
},
{
"type": "I/SigI",
"value": 22.1
},
{
"type": "Completeness",
"value": 96.6
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.56,1.53],
"number_observations_unique": 2456,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.451
},
{
"type": "R(pim)",
"value": 0.238
},
{
"type": "I/SigI",
"value": 4.2
},
{
"type": "Completeness",
"value": 89.4
},
{
"type": "Redundancy",
"value": 4.1
},
{
"type": "CC(1/2)",
"value": 0.863
}
]
}
]
}