Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "23e18baa3e44d76a5874d326f071c5f6",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 55.052,
"b": 80.998,
"c": 88.745,
"alpha": 90.00,
"beta": 96.84,
"gamma": 90.00
},
"wavelengths": [1.54060],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.63,1.80],
"number_observations_unique": 33593,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 33.35
},
{
"type": "Completeness",
"value": 93.6
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.87,1.80],
"number_observations_unique": 3228,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.379
},
{
"type": "R(pim)",
"value": 0.210
},
{
"type": "I/SigI",
"value": 3.54
},
{
"type": "Completeness",
"value": 89.9
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.805
}
]
}
]
}