Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e70754d2d2a8b08a2450a9f58202c8e2",
"space_group_name": "P 31",
"unit_cell": {
"a": 33.910,
"b": 33.910,
"c": 47.461,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.460,1.650],
"number_observations": 65231,
"number_observations_unique": 7383,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 8.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 3628,
"number_observations_unique": 398,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.023
},
{
"type": "R(meas)",
"value": 2.144
},
{
"type": "R(pim)",
"value": 0.704
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.100
},
{
"type": "CC(1/2)",
"value": 0.485
}
]
},
{
"resolution_limits": [47.460,8.890],
"number_observations": 486,
"number_observations_unique": 53,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 43.000
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 9.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}