Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9f88732fdf91c85f70bcb0912ac08d7c",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 125.696,
"b": 108.463,
"c": 75.697,
"alpha": 90.00,
"beta": 108.98,
"gamma": 90.00
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.437,1.493],
"number_observations": 337165,
"number_observations_unique": 100570,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 12.600
},
{
"type": "Completeness",
"value": 93.300
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.655,1.493],
"number_observations": 13755,
"number_observations_unique": 5031,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.691
},
{
"type": "R(pim)",
"value": 0.412
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 79.600
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.669
}
]
},
{
"resolution_limits": [55.437,4.713],
"number_observations": 17275,
"number_observations_unique": 5027,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.026
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 40.800
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}