Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e8df6bd04d55e31938e052f5fd528a5d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 77.961,
"b": 46.450,
"c": 63.771,
"alpha": 90.00,
"beta": 94.98,
"gamma": 90.00
},
"wavelengths": [0.97856],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.864,2.095],
"number_observations_unique": 12964,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 10.6
},
{
"type": "Completeness",
"value": 95.8
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.132,2.095],
"number_observations_unique": 657,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.545
},
{
"type": "R(meas)",
"value": 0.592
},
{
"type": "R(pim)",
"value": 0.227
},
{
"type": "I/SigI",
"value": 3.3
},
{
"type": "Completeness",
"value": 96.8
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.904
}
]
}
]
}