Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2bab042817e1f43fcf8d7bb04910484d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.690,
"b": 41.711,
"c": 72.287,
"alpha": 90.00,
"beta": 104.21,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.9,1.54],
"number_observations_unique": 35625,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2549
},
{
"type": "R(meas)",
"value": 0.3014
},
{
"type": "R(pim)",
"value": 0.1591
},
{
"type": "I/SigI",
"value": 18.56
},
{
"type": "Completeness",
"value": 96.79
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.854
}
]
},
"refln_shells": [
{
"resolution_limits": [1.595,1.54],
"number_observations_unique": 3017,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.4391
},
{
"type": "R(meas)",
"value": 0.5443
},
{
"type": "R(pim)",
"value": 0.3146
},
{
"type": "I/SigI",
"value": 2.32
},
{
"type": "CC(1/2)",
"value": 0.911
}
]
}
]
}