Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "107301a72f6ac029d039b78449976c5a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 100.415,
"b": 44.993,
"c": 51.508,
"alpha": 90.0,
"beta": 116.2,
"gamma": 90.0
},
"wavelengths": [0.97915],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.16,2.13],
"number_observations": 76012,
"number_observations_unique": 11392,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 14.2
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.24,2.13],
"number_observations": 10962,
"number_observations_unique": 1654,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.954
},
{
"type": "R(meas)",
"value": 1.036
},
{
"type": "R(pim)",
"value": 0.400
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.883
}
]
}
]
}