Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d021cd2cc22b9e3874465b5f3824df90",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 86.557,
"b": 86.557,
"c": 95.598,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.80,3.47],
"number_observations_unique": 5035,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "R(meas)",
"value": 0.136
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 15.8
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 24.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.80,3.47],
"number_observations_unique": 1138,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.912
},
{
"type": "R(meas)",
"value": 3.013
},
{
"type": "R(pim)",
"value": 0.582
},
{
"type": "I/SigI",
"value": 1.60
},
{
"type": "Completeness",
"value": 96.8
},
{
"type": "Redundancy",
"value": 25.6
},
{
"type": "CC(1/2)",
"value": 0.548
}
]
}
]
}