Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4c59199349cc4bc90e9840561f17f098",
"space_group_name": "P 1",
"unit_cell": {
"a": 63.376,
"b": 81.675,
"c": 93.548,
"alpha": 66.57,
"beta": 89.39,
"gamma": 89.17
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [85.830,2.410],
"number_observations": 130173,
"number_observations_unique": 62881,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.160
},
{
"type": "R(pim)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 6.500
},
{
"type": "Completeness",
"value": 94.500
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [2.540,2.410],
"number_observations": 17322,
"number_observations_unique": 9222,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.881
},
{
"type": "R(meas)",
"value": 1.188
},
{
"type": "R(pim)",
"value": 0.790
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.412
}
]
},
{
"resolution_limits": [85.830,7.620],
"number_observations": 4311,
"number_observations_unique": 1862,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 17.400
},
{
"type": "Completeness",
"value": 88.300
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}