Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b4af6675da4e95c6c865b9140670bc14",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.101,
"b": 53.189,
"c": 45.609,
"alpha": 90.00,
"beta": 102.02,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.69],
"number_observations_unique": 7315,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 15.68
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [2.74,2.69],
"number_observations_unique": 340,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.361
},
{
"type": "I/SigI",
"value": 2.38
},
{
"type": "Completeness",
"value": 95.8
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.854
}
]
}
]
}