Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "269f463ec8ce6889adf48e3cd3fddca6",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 85.234,
"b": 85.234,
"c": 209.809,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.3],
"number_observations_unique": 20799,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(meas)",
"value": 0.159
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 14.22
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 8.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.34,2.30],
"number_observations_unique": 996,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.945
},
{
"type": "I/SigI",
"value": 2.24
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 7.7
},
{
"type": "CC(1/2)",
"value": 0.629
}
]
}
]
}