Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6de816cc8b7427056fbe9bc6c93ef54b",
"space_group_name": "P 1",
"unit_cell": {
"a": 83.874,
"b": 83.858,
"c": 88.438,
"alpha": 106.66,
"beta": 109.25,
"gamma": 94.84
},
"wavelengths": [0.97850],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.510,2.46],
"number_observations": 262030,
"number_observations_unique": 75400,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.163
},
{
"type": "R(pim)",
"value": 0.098
},
{
"type": "I/SigI",
"value": 6.800
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.947
}
]
},
"refln_shells": [
{
"resolution_limits": [2.510,2.46],
"number_observations": 14943,
"number_observations_unique": 4396,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.627
},
{
"type": "R(pim)",
"value": 0.381
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.590
}
]
},
{
"resolution_limits": [50.510,12.300],
"number_observations": 2278,
"number_observations_unique": 593,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 13.300
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.975
}
]
}
]
}