Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f23efa27ab53a39be68d4aa5d1f3feb1",
"space_group_name": "P 1",
"unit_cell": {
"a": 55.93,
"b": 73.45,
"c": 91.03,
"alpha": 109.12,
"beta": 91.25,
"gamma": 91.56
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.880,1.850],
"number_observations": 218706,
"number_observations_unique": 111170,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 10.200
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.900,1.850],
"number_observations_unique": 8126,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.821
},
{
"type": "R(meas)",
"value": 1.161
},
{
"type": "R(pim)",
"value": 0.821
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.491
}
]
},
{
"resolution_limits": [55.880,8.270],
"number_observations_unique": 1237,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.014
},
{
"type": "R(meas)",
"value": 0.020
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "Completeness",
"value": 95.000
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}