Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c4fd76ab2fccfebc90fe098afbdbbaee",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.689,
"b": 51.337,
"c": 78.541,
"alpha": 90.00,
"beta": 93.14,
"gamma": 90.00
},
"wavelengths": [0.95374],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.622,2.05],
"number_observations_unique": 22497,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.252
},
{
"type": "R(meas)",
"value": 0.276
},
{
"type": "R(pim)",
"value": 0.109
},
{
"type": "I/SigI",
"value": 6.1
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [2.11,2.05],
"number_observations": 10391,
"number_observations_unique": 1727,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.289
},
{
"type": "R(meas)",
"value": 1.414
},
{
"type": "R(pim)",
"value": 0.574
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.621
}
]
}
]
}