Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7a3525d94bb721d660b6836e0e49d784",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 140.330,
"b": 180.059,
"c": 255.612,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97970],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.180,3.300],
"number_observations": 730152,
"number_observations_unique": 97950,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.179
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 10.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [3.360,3.300],
"number_observations": 36672,
"number_observations_unique": 4826,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.840
},
{
"type": "R(pim)",
"value": 0.713
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.600
},
{
"type": "CC(1/2)",
"value": 0.497
}
]
},
{
"resolution_limits": [49.180,18.070],
"number_observations": 2901,
"number_observations_unique": 639,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 23.900
},
{
"type": "Completeness",
"value": 93.500
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}