Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ddd92d12a92d750f4e0fd5c895687d34",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 102.854,
"b": 112.294,
"c": 71.343,
"alpha": 90.000,
"beta": 106.329,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,1.80],
"number_observations_unique": 71494,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 11.68
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.82,1.80],
"number_observations_unique": 3520,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.577
},
{
"type": "I/SigI",
"value": 2.00
},
{
"type": "Completeness",
"value": 94.7
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.695
}
]
}
]
}