Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ce5bfe9bc79a61467245f2d93a7494a0",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.907,
"b": 98.731,
"c": 103.487,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97853],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.81,1.74],
"number_observations_unique": 71966,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 22.8
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 25.8
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.77,1.74],
"number_observations_unique": 3883,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.925
},
{
"type": "R(pim)",
"value": 0.390
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 24.5
},
{
"type": "CC(1/2)",
"value": 0.794
}
]
}
]
}