Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dd291622cda34b8764e7685b4ef431fc",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 48.742,
"b": 48.742,
"c": 191.029,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.76,1.93],
"number_observations_unique": 20813,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 18.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 10.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [47.76,9.05],
"number_observations_unique": 269,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 53.8
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 8.3
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [1.98,1.93],
"number_observations_unique": 1357,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.891
},
{
"type": "R(meas)",
"value": 2.076
},
{
"type": "R(pim)",
"value": 0.853
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 0.523
}
]
}
]
}