Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ed3ed2ce9970075b6a40f4208ea5ab7e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 159.65,
"b": 70.62,
"c": 230.34,
"alpha": 90.00,
"beta": 104.52,
"gamma": 90.00
},
"wavelengths": [0.87260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,3.1],
"number_observations_unique": 45457,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.01
},
{
"type": "I/SigI",
"value": 6.1
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
},
"refln_shells": [
{
"resolution_limits": [3.21,3.10],
"number_observations_unique": 4483,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.0
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.29
}
]
}
]
}