Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "46a19306a518f7f29bbc7fb3761b6f1d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 119.653,
"b": 83.674,
"c": 55.157,
"alpha": 90.00,
"beta": 92.26,
"gamma": 90.00
},
"wavelengths": [0.97853],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.437,1.56],
"number_observations_unique": 72920,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 18.5
},
{
"type": "Completeness",
"value": 94.4
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.587,1.560],
"number_observations_unique": 3126,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.371
},
{
"type": "R(meas)",
"value": 0.403
},
{
"type": "R(pim)",
"value": 0.155
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 80.6
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.940
}
]
}
]
}