Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "58f57d6fb871f1f4cd6dc22380a69513",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.565,
"b": 61.200,
"c": 65.009,
"alpha": 90.0,
"beta": 92.8,
"gamma": 90.0
},
"wavelengths": [0.92204],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.45,1.27],
"number_observations": 394620,
"number_observations_unique": 70797,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 12.4
},
{
"type": "Completeness",
"value": 94.6
},
{
"type": "Redundancy",
"value": 5.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.29,1.27],
"number_observations": 4577,
"number_observations_unique": 2138,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.119
},
{
"type": "R(meas)",
"value": 1.520
},
{
"type": "R(pim)",
"value": 1.017
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.353
}
]
}
]
}