Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5cf4e04e234c528f8c6e8695fa8f48c3",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 115.504,
"b": 97.153,
"c": 127.249,
"alpha": 90.00,
"beta": 93.53,
"gamma": 90.00
},
"wavelengths": [0.87313],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.34,3.089],
"number_observations_unique": 51326,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1975
},
{
"type": "R(meas)",
"value": 0.236
},
{
"type": "R(pim)",
"value": 0.1277
},
{
"type": "I/SigI",
"value": 5.70
},
{
"type": "Completeness",
"value": 98.90
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [3.189,3.089],
"number_observations_unique": 4938,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.143
},
{
"type": "R(meas)",
"value": 1.362
},
{
"type": "R(pim)",
"value": 0.7334
},
{
"type": "I/SigI",
"value": 1.08
},
{
"type": "Completeness",
"value": 95.79
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.365
}
]
}
]
}