Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7a622db56463a099f5594b86b52196bc",
"space_group_name": "P 1",
"unit_cell": {
"a": 24.64,
"b": 34.00,
"c": 39.49,
"alpha": 68.56,
"beta": 74.31,
"gamma": 72.95
},
"wavelengths": [0.97916],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [18.067,1.175],
"number_observations": 83751,
"number_observations_unique": 32239,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 5.800
},
{
"type": "Completeness",
"value": 86.300
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [1.179,1.175],
"number_observations": 842,
"number_observations_unique": 331,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.401
},
{
"type": "R(meas)",
"value": 0.512
},
{
"type": "R(pim)",
"value": 0.316
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 87.100
},
{
"type": "Redundancy",
"value": 2.500
},
{
"type": "CC(1/2)",
"value": 0.863
}
]
},
{
"resolution_limits": [18.067,5.406],
"number_observations": 668,
"number_observations_unique": 273,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 6.500
},
{
"type": "Completeness",
"value": 72.000
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
}
]
}