Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9e4c3edcd162235a8ec9b760567126cf",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 96.905,
"b": 52.501,
"c": 81.212,
"alpha": 90.0,
"beta": 95.2,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.480,1.70],
"number_observations": 485775,
"number_observations_unique": 46782,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.151
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 7.98
},
{
"type": "Completeness",
"value": 99.99
},
{
"type": "Redundancy",
"value": 7.46
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.74,1.70],
"number_observations": 1116,
"number_observations_unique": 853,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 1.079
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [32.480,7.870],
"number_observations": 3437,
"number_observations_unique": 483,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 34.700
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 7.100
}
]
}
]
}