Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1fb1c358ee6e09aaab12b7b6a205f55e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.772,
"b": 85.700,
"c": 76.227,
"alpha": 90.00,
"beta": 92.62,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [76.147,1.472],
"number_observations_unique": 52439,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.094
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 10.1
},
{
"type": "Completeness",
"value": 56.5
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.673,1.472],
"number_observations_unique": 2623,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.691
},
{
"type": "R(meas)",
"value": 0.800
},
{
"type": "R(pim)",
"value": 0.397
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 8.9
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.630
}
]
}
]
}