Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "18d049b75b199ae9b25af5cfc0c56013",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.298,
"b": 41.739,
"c": 72.337,
"alpha": 90.000,
"beta": 104.106,
"gamma": 90.000
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.739,1.039],
"number_observations_unique": 112924,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 10.56
},
{
"type": "Completeness",
"value": 95.9
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [1.10,1.04],
"number_observations_unique": 15400,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.153
},
{
"type": "I/SigI",
"value": 4.26
},
{
"type": "Completeness",
"value": 81.1
},
{
"type": "Redundancy",
"value": 2.89
},
{
"type": "CC(1/2)",
"value": 0.967
}
]
}
]
}