Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1fcbacefe7334e5f1d2b251b4c161655",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 82.869,
"b": 57.290,
"c": 91.979,
"alpha": 90.00,
"beta": 93.12,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [63.21,1.90],
"number_observations": 209259,
"number_observations_unique": 33364,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 11.8
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.94,1.90],
"number_observations": 12795,
"number_observations_unique": 2182,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.764
},
{
"type": "R(meas)",
"value": 0.839
},
{
"type": "R(pim)",
"value": 0.343
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.815
}
]
}
]
}