Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2eab08de6febd4988acce9b36e6a7304",
"space_group_name": "P 42 21 2",
"unit_cell": {
"a": 147.439,
"b": 147.439,
"c": 131.713,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.150,3.370],
"number_observations": 222236,
"number_observations_unique": 20918,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.310
},
{
"type": "R(pim)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 9.300
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [3.640,3.370],
"number_observations": 41285,
"number_observations_unique": 4044,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.025
},
{
"type": "R(pim)",
"value": 0.665
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 94.700
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.218
}
]
},
{
"resolution_limits": [49.150,8.910],
"number_observations": 11967,
"number_observations_unique": 1274,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 30.000
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 9.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}