Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7f1c85ed439cdd9b2a2e75eeca16a0c4",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.522,
"b": 41.230,
"c": 71.873,
"alpha": 90.000,
"beta": 104.055,
"gamma": 90.000
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.0,1.20],
"number_observations_unique": 73833,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 23.1
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations_unique": 3557,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.297
},
{
"type": "R(meas)",
"value": 0.320
},
{
"type": "R(pim)",
"value": 0.118
},
{
"type": "I/SigI",
"value": 8.4
},
{
"type": "Completeness",
"value": 94.7
},
{
"type": "Redundancy",
"value": 7.3
},
{
"type": "CC(1/2)",
"value": 0.956
}
]
}
]
}