Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8222ef7d5f99d7e4c58178783fabd8e5",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 68.34,
"b": 68.34,
"c": 105.12,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20,2.1],
"number_observations_unique": 71235,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.299
},
{
"type": "R(meas)",
"value": 0.357
},
{
"type": "R(pim)",
"value": 0.144
},
{
"type": "I/SigI",
"value": 3.61
},
{
"type": "Completeness",
"value": 82.5
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.964
}
]
},
"refln_shells": [
{
"resolution_limits": [2.15,2.10],
"number_observations_unique": 5348,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.210
},
{
"type": "R(meas)",
"value": 1.441
},
{
"type": "I/SigI",
"value": 1.02
},
{
"type": "Completeness",
"value": 83.3
},
{
"type": "CC(1/2)",
"value": 0.347
}
]
}
]
}