Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fac6d00c5b63500dc0b618f4dbe39aee",
"space_group_name": "H 3",
"unit_cell": {
"a": 71.540,
"b": 71.540,
"c": 225.394,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [75.131,1.65],
"number_observations_unique": 51766,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.150
},
{
"type": "R(meas)",
"value": 0.184
},
{
"type": "R(pim)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 9.1
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [75.13,9.04],
"number_observations_unique": 322,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [1.68,1.65],
"number_observations_unique": 2600,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.997
},
{
"type": "R(meas)",
"value": 1.222
},
{
"type": "R(pim)",
"value": 0.690
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.325
}
]
}
]
}