Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "44ee15d53419d55fcc506a3949117515",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 69.280,
"b": 69.280,
"c": 35.441,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.78,1.65],
"number_observations_unique": 6134,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 17.6
},
{
"type": "Completeness",
"value": 96.5
},
{
"type": "Redundancy",
"value": 20.4
}
]
},
"refln_shells": [
{
"resolution_limits": [1.68,1.65],
"number_observations_unique": 269,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.356
},
{
"type": "R(meas)",
"value": 1.393
},
{
"type": "R(pim)",
"value": 0.316
},
{
"type": "I/SigI",
"value": 2.7
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 18.8
},
{
"type": "CC(1/2)",
"value": 0.682
}
]
},
{
"resolution_limits": [24.78,9.04],
"number_observations_unique": 53,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 50.4
},
{
"type": "Completeness",
"value": 95.4
},
{
"type": "Redundancy",
"value": 14.5
},
{
"type": "CC(1/2)",
"value": 1
}
]
}
]
}