Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "f30c020bd24fe25cb2af8d6543da26ba",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 84.256,
"b": 84.256,
"c": 66.578,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.58,1.97],
"number_observations": 336247,
"number_observations_unique": 16782,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 26.1
},
{
"type": "Completeness",
"value": 96.0
},
{
"type": "Redundancy",
"value": 20.0
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.08,1.97],
"number_observations": 52496,
"number_observations_unique": 2492,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.054
},
{
"type": "R(meas)",
"value": 1.080
},
{
"type": "R(pim)",
"value": 0.234
},
{
"type": "I/SigI",
"value": 3.1
},
{
"type": "Redundancy",
"value": 21.1
},
{
"type": "CC(1/2)",
"value": 0.872
}
]
}
]
}