Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b46b26a519e97c2f6b3147e96e1628fd",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 85.221,
"b": 120.999,
"c": 191.034,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03321],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [95.52,2.72],
"number_observations_unique": 50359,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.103
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 12.2
},
{
"type": "Completeness",
"value": 93.6
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.87,2.72],
"number_observations_unique": 7722,
"quality_factors": [
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 7
},
{
"type": "CC(1/2)",
"value": 0.805
}
]
}
]
}