Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "164769982fd0cdc8770a2d7eef0a06ea",
"space_group_name": "P 1",
"unit_cell": {
"a": 42.620,
"b": 52.990,
"c": 54.019,
"alpha": 88.90,
"beta": 90.83,
"gamma": 70.53
},
"wavelengths": [0.97372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.00,2.16],
"number_observations_unique": 23220,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2
},
{
"type": "I/SigI",
"value": 7.0
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.944
}
]
},
"refln_shells": [
{
"resolution_limits": [2.28,2.16],
"number_observations_unique": 3080,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.6
},
{
"type": "I/SigI",
"value": 3.2
},
{
"type": "Completeness",
"value": 88.9
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.64
}
]
}
]
}