Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "406e0ce01a7f66d9097f81a78b7f3fb7",
"space_group_name": "P 42 2 2",
"unit_cell": {
"a": 63.729,
"b": 63.729,
"c": 63.153,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.71,1.98],
"number_observations": 232505,
"number_observations_unique": 9583,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.211
},
{
"type": "R(meas)",
"value": 0.216
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 18.6
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 24.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.03,1.98],
"number_observations": 18088,
"number_observations_unique": 697,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.161
},
{
"type": "R(pim)",
"value": 0.427
},
{
"type": "I/SigI",
"value": 8.1
},
{
"type": "Redundancy",
"value": 26.0
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
}
]
}