Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bcf1d160ff512e95f80620b0b9cab1f9",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.380,
"b": 66.392,
"c": 48.295,
"alpha": 90.00,
"beta": 116.97,
"gamma": 90.00
},
"wavelengths": [1.18069],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.08,1.48],
"number_observations_unique": 42293,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 14.5
},
{
"type": "Completeness",
"value": 99
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.51,1.48],
"number_observations_unique": 2063,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.765
},
{
"type": "R(meas)",
"value": 0.842
},
{
"type": "R(pim)",
"value": 0.346
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 5.8
},
{
"type": "CC(1/2)",
"value": 0.636
}
]
}
]
}