Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e930bd765bdff9605c039156b31606e5",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 38.430,
"b": 54.783,
"c": 143.188,
"alpha": 90.00,
"beta": 96.25,
"gamma": 90.00
},
"wavelengths": [0.95400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.93,2.9],
"number_observations_unique": 6688,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 12.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.08,2.9],
"number_observations_unique": 1072,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.739
},
{
"type": "R(pim)",
"value": 0.315
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.909
}
]
}
]
}