Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7d032e3d0fe3ca2c13e958810eef4f37",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 40.787,
"b": 51.606,
"c": 74.597,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [15.64,1.30],
"number_observations": 225700,
"number_observations_unique": 39490,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "R(meas)",
"value": 0.094
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 11.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.32,1.30],
"number_observations": 9419,
"number_observations_unique": 1954,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.025
},
{
"type": "R(meas)",
"value": 1.153
},
{
"type": "R(pim)",
"value": 0.519
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.593
}
]
}
]
}