Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "ee88f1c2c032c610ad4e56e2df4e89ee",
"space_group_name": "P 1",
"unit_cell": {
"a": 43.804,
"b": 49.817,
"c": 92.465,
"alpha": 93.05,
"beta": 102.79,
"gamma": 108.27
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.99,1.44],
"number_observations": 236143,
"number_observations_unique": 95034,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 73.8
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.52,1.44],
"number_observations": 26983,
"number_observations_unique": 12032,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.606
},
{
"type": "R(meas)",
"value": 0.774
},
{
"type": "R(pim)",
"value": 0.475
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Redundancy",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.478
}
]
}
]
}