Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "42d2fef6172616c1641ed21c5d2a8cfc",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 87.537,
"b": 90.440,
"c": 160.514,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.07500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [80.260,2.540],
"number_observations": 155685,
"number_observations_unique": 21454,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 26.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.840,2.540],
"number_observations": 44373,
"number_observations_unique": 6013,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.712
},
{
"type": "R(pim)",
"value": 0.281
},
{
"type": "I/SigI",
"value": 3.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.400
},
{
"type": "CC(1/2)",
"value": 0.853
}
]
},
{
"resolution_limits": [80.260,5.680],
"number_observations": 13879,
"number_observations_unique": 2036,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 73.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}