Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3d7a4e74174e6db52ddd02336d5cac60",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.080,
"b": 53.451,
"c": 44.394,
"alpha": 90.00,
"beta": 100.84,
"gamma": 90.00
},
"wavelengths": [0.91266],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.02,1.49],
"number_observations": 131568,
"number_observations_unique": 42814,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 12.1
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.52,1.49],
"number_observations": 5053,
"number_observations_unique": 2081,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.915
},
{
"type": "R(meas)",
"value": 1.172
},
{
"type": "R(pim)",
"value": 0.721
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.153
}
]
}
]
}