Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bf7d2c44f8ffd59fcea1591662396dd2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 77.35,
"b": 66.56,
"c": 80.77,
"alpha": 90.00,
"beta": 98.47,
"gamma": 90.00
},
"wavelengths": [0.95400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.78,2.20],
"number_observations_unique": 40122,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 8.8
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.27,2.20],
"number_observations_unique": 3209,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.606
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 89.5
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.795
}
]
}
]
}