Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e9ecc7ebcff66439f113aa799998e3c0",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 176.030,
"b": 176.030,
"c": 108.071,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.7],
"number_observations_unique": 27622,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.240
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 16.9
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 38.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.85,2.70],
"number_observations": 138109,
"number_observations_unique": 3949,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.840
},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 35.0
},
{
"type": "CC(1/2)",
"value": 0.415
}
]
},
{
"resolution_limits": [50.00,8.54],
"number_observations": 35458,
"number_observations_unique": 1002,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 57.5
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 35.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}