Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "3f052f1a16a8dbe97288ae57a29e692f",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.89,
"b": 81.89,
"c": 135.28,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.950,1.800],
"number_observations": 980574,
"number_observations_unique": 49344,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "R(meas)",
"value": 0.128
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 16.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.850,1.800],
"number_observations": 71069,
"number_observations_unique": 3582,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.807
},
{
"type": "R(meas)",
"value": 4.931
},
{
"type": "R(pim)",
"value": 1.097
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.800
},
{
"type": "CC(1/2)",
"value": 0.347
}
]
},
{
"resolution_limits": [48.950,8.050],
"number_observations": 10075,
"number_observations_unique": 636,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 59.100
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 15.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}