Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1ef4b989b918e5449e660778849ace67",
"space_group_name": "P 41 2 2",
"unit_cell": {
"a": 59.823,
"b": 59.823,
"c": 110.552,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.270,1.620],
"number_observations": 327880,
"number_observations_unique": 26364,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.100
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 11.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.660,1.620],
"number_observations": 22613,
"number_observations_unique": 1915,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.966
},
{
"type": "R(meas)",
"value": 2.056
},
{
"type": "R(pim)",
"value": 0.592
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.640
}
]
},
{
"resolution_limits": [55.270,7.250],
"number_observations": 3990,
"number_observations_unique": 378,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 31.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}