Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b634d213f9f42f84c7467126ffd559bd",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 35.197,
"b": 59.808,
"c": 58.256,
"alpha": 90.00,
"beta": 102.69,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.808,1.809],
"number_observations_unique": 21491,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 3.7
},
{
"type": "Completeness",
"value": 99.28
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.815,1.809],
"number_observations_unique": 531,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.448
},
{
"type": "R(pim)",
"value": 0.314
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 90.8
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.774
}
]
}
]
}