Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7a3328ccbe8a6275450db737f099bfa9",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 58.792,
"b": 58.792,
"c": 146.068,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.690,1.950],
"number_observations": 511574,
"number_observations_unique": 19665,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.236
},
{
"type": "R(meas)",
"value": 0.241
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 11.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 26.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.990,1.950],
"number_observations": 34144,
"number_observations_unique": 1333,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.134
},
{
"type": "R(meas)",
"value": 3.196
},
{
"type": "R(pim)",
"value": 0.617
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 25.600
},
{
"type": "CC(1/2)",
"value": 0.595
}
]
},
{
"resolution_limits": [48.690,8.920],
"number_observations": 5795,
"number_observations_unique": 273,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 58.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 21.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}