Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "778bb33fc50d456eae79841ea6eaa836",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.133,
"b": 52.602,
"c": 44.654,
"alpha": 90.00,
"beta": 102.96,
"gamma": 90.00
},
"wavelengths": [0.91258],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.73,1.29],
"number_observations": 139197,
"number_observations_unique": 56505,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.080
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 8.2
},
{
"type": "Completeness",
"value": 88.5
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.31,1.29],
"number_observations": 1362,
"number_observations_unique": 1276,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.599
},
{
"type": "R(meas)",
"value": 0.848
},
{
"type": "R(pim)",
"value": 0.599
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 1.1
},
{
"type": "CC(1/2)",
"value": 0.579
}
]
}
]
}