Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "45ba226232ce0caa7b93453b41905486",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.49,
"b": 68.01,
"c": 40.30,
"alpha": 90.00,
"beta": 93.75,
"gamma": 90.00
},
"wavelengths": [0.97965],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.21,1.21],
"number_observations_unique": 62965,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 18.3
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.24,1.21],
"number_observations_unique": 3525,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.252
},
{
"type": "R(meas)",
"value": 0.292
},
{
"type": "R(pim)",
"value": 0.144
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 74.7
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.933
}
]
}
]
}