Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e76ff04eb965b481730b0b1740ddf316",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.498,
"b": 71.498,
"c": 150.300,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.420,1.340],
"number_observations": 1025067,
"number_observations_unique": 88131,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 21.300
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 11.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.360,1.340],
"number_observations": 19812,
"number_observations_unique": 4063,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.739
},
{
"type": "R(meas)",
"value": 0.828
},
{
"type": "R(pim)",
"value": 0.358
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 0.633
}
]
},
{
"resolution_limits": [29.420,7.340],
"number_observations": 7130,
"number_observations_unique": 653,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 51.800
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 10.900
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
}
]
}