Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "604b41ea6f9f352e291d987f9f849915",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.762,
"b": 88.762,
"c": 39.591,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.380,0.990],
"number_observations": 1060371,
"number_observations_unique": 170459,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 13.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 32228,
"number_observations_unique": 7597,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.047
},
{
"type": "R(meas)",
"value": 1.190
},
{
"type": "R(pim)",
"value": 0.551
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 90.700
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.611
}
]
},
{
"resolution_limits": [44.380,5.420],
"number_observations": 7763,
"number_observations_unique": 1132,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 44.700
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}