Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "98a044dcb124df43541066e9c0197929",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.858,
"b": 53.627,
"c": 44.761,
"alpha": 90.00,
"beta": 101.28,
"gamma": 90.00
},
"wavelengths": [0.91261],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.82,1.73],
"number_observations": 89210,
"number_observations_unique": 27773,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.124
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.952
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.73],
"number_observations": 5005,
"number_observations_unique": 1504,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.709
},
{
"type": "R(meas)",
"value": 2.038
},
{
"type": "R(pim)",
"value": 1.099
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.301
}
]
}
]
}