Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6c04d89a19e656d14a8cf54a5bdb0959",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 36.33,
"b": 79.06,
"c": 99.06,
"alpha": 90.00,
"beta": 94.97,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.9,1.7],
"number_observations_unique": 59910,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 17.8
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 11.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.8,1.7],
"number_observations_unique": 8846,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.038
},
{
"type": "R(pim)",
"value": 0.445
},
{
"type": "Completeness",
"value": 91.6
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.656
}
]
}
]
}