Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fe4e05d509fe1eb0fb79c867a5819eae",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 38.385,
"b": 33.219,
"c": 125.800,
"alpha": 90.00,
"beta": 97.18,
"gamma": 90.00
},
"wavelengths": [0.92120],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [124.92,1.51],
"number_observations": 322575,
"number_observations_unique": 49343,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.217
},
{
"type": "R(meas)",
"value": 0.236
},
{
"type": "R(pim)",
"value": 0.092
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.975
}
]
},
"refln_shells": [
{
"resolution_limits": [1.54,1.51],
"number_observations": 13333,
"number_observations_unique": 2512,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.073
},
{
"type": "R(meas)",
"value": 2.305
},
{
"type": "R(pim)",
"value": 0.985
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.327
}
]
}
]
}