Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7fbda0de2503f3eb26e741ea85d4f1dd",
"space_group_name": "P 1",
"unit_cell": {
"a": 40.225,
"b": 42.281,
"c": 47.088,
"alpha": 88.19,
"beta": 64.78,
"gamma": 75.24
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.44,1.90],
"number_observations": 27033,
"number_observations_unique": 14392,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 5.5
},
{
"type": "Completeness",
"value": 67.5
},
{
"type": "Redundancy",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.94,1.90],
"number_observations": 415,
"number_observations_unique": 237,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.573
},
{
"type": "R(meas)",
"value": 0.772
},
{
"type": "R(pim)",
"value": 0.513
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.533
}
]
}
]
}