Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "93cc900863df6cf3760feb5f056d8672",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 56.23,
"b": 83.34,
"c": 106.62,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [15.540,1.960],
"number_observations": 252057,
"number_observations_unique": 35891,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.010,1.960],
"number_observations": 11028,
"number_observations_unique": 1880,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.614
},
{
"type": "R(pim)",
"value": 0.267
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 73.500
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.897
}
]
},
{
"resolution_limits": [15.540,8.990],
"number_observations": 2307,
"number_observations_unique": 361,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 34.400
},
{
"type": "Completeness",
"value": 80.900
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}