Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4bd4eaa25b018cfd5892dee80a15b851",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 123.505,
"b": 194.201,
"c": 112.006,
"alpha": 90.000,
"beta": 116.598,
"gamma": 90.000
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.40],
"number_observations_unique": 451842,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 15.6
},
{
"type": "Completeness",
"value": 98
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.48,1.40],
"number_observations_unique": 64988,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.755
},
{
"type": "R(meas)",
"value": 0.820
},
{
"type": "R(pim)",
"value": 0.318
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 96.6
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.810
}
]
}
]
}