Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "79b200265f9ab5bf858447e1d64ab6c4",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 57.222,
"b": 34.299,
"c": 71.229,
"alpha": 90.00,
"beta": 97.41,
"gamma": 90.00
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.32,1.50],
"number_observations_unique": 21772,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.06
},
{
"type": "I/SigI",
"value": 18.08
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.58,1.50],
"number_observations_unique": 3148,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.632
},
{
"type": "I/SigI",
"value": 2.03
},
{
"type": "Completeness",
"value": 87.3
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.804
}
]
}
]
}