Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "6fd4c621e771ecdfdf10451896c7f4f4",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 82.08,
"b": 82.08,
"c": 135.73,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [27.950,2.280],
"number_observations": 466088,
"number_observations_unique": 24758,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.180
},
{
"type": "R(meas)",
"value": 0.185
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 11.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 18.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.340,2.280],
"number_observations": 36120,
"number_observations_unique": 1809,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.009
},
{
"type": "R(meas)",
"value": 2.062
},
{
"type": "R(pim)",
"value": 0.459
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 0.838
}
]
},
{
"resolution_limits": [27.950,10.200],
"number_observations": 3819,
"number_observations_unique": 311,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 25.900
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}