Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4c64eb3496dc74df60934374600024a2",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 148.0,
"b": 55.8,
"c": 81.6,
"alpha": 90.0,
"beta": 103.6,
"gamma": 90.0
},
"wavelengths": [1.77000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.962,2.400],
"number_observations": 184910,
"number_observations_unique": 25587,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 14.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.490,2.400],
"number_observations": 18998,
"number_observations_unique": 2624,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.679
},
{
"type": "R(pim)",
"value": 0.270
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.954
}
]
},
{
"resolution_limits": [47.960,8.980],
"number_observations": 3469,
"number_observations_unique": 526,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 33.600
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}