Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3acfa2f58ccfb4c2354728b2531df640",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 61.87,
"b": 85.04,
"c": 59.84,
"alpha": 90.0,
"beta": 99.0,
"gamma": 90.0
},
"wavelengths": [1.54178],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [26.940,1.650],
"number_observations": 147086,
"number_observations_unique": 36423,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 10.700
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations_unique": 1755,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.916
},
{
"type": "R(meas)",
"value": 1.064
},
{
"type": "R(pim)",
"value": 0.532
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.591
}
]
},
{
"resolution_limits": [26.940,9.040],
"number_observations_unique": 230,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}