Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "678c39be6d1be30683e52aba434e4922",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 137.929,
"b": 78.643,
"c": 107.005,
"alpha": 90.000,
"beta": 93.117,
"gamma": 90.000
},
"wavelengths": [0.87310],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.640,2.651],
"number_observations_unique": 31523,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 5.0
},
{
"type": "Completeness",
"value": 94.4
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [2.697,2.651],
"number_observations_unique": 1555,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.299
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 96.3
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.842
}
]
}
]
}