Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "53de181bb390457fbcd4b8615c1b3c59",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.38,
"b": 41.48,
"c": 72.33,
"alpha": 90.000,
"beta": 104.531,
"gamma": 90.000
},
"wavelengths": [0.97170],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.47,1.22],
"number_observations_unique": 58986,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 15.65
},
{
"type": "Completeness",
"value": 81.9
},
{
"type": "Redundancy",
"value": 5.47
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.25,1.22],
"number_observations_unique": 1034,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.281
},
{
"type": "R(meas)",
"value": 0.383
},
{
"type": "I/SigI",
"value": 2.36
},
{
"type": "Redundancy",
"value": 2.05
},
{
"type": "CC(1/2)",
"value": 0.826
}
]
}
]
}