Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "9a4593a0b9e6c11b9520a8630354ea14",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 33.527,
"b": 70.663,
"c": 70.052,
"alpha": 90.000,
"beta": 93.285,
"gamma": 90.000
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.33,1.6],
"number_observations_unique": 42640,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0644
},
{
"type": "R(meas)",
"value": 0.0697
},
{
"type": "R(pim)",
"value": 0.0264
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 98.76
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.64,1.6],
"number_observations_unique": 3021,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.16
},
{
"type": "R(meas)",
"value": 3.42
},
{
"type": "R(pim)",
"value": 1.29
},
{
"type": "I/SigI",
"value": 0.59
},
{
"type": "Completeness",
"value": 98.25
},
{
"type": "Redundancy",
"value": 7
},
{
"type": "CC(1/2)",
"value": 0.323
}
]
}
]
}