Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "32943f4149ff906a24bbf9d0fb253a2a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.557,
"b": 53.461,
"c": 44.495,
"alpha": 90.00,
"beta": 101.68,
"gamma": 90.00
},
"wavelengths": [0.91256],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.66,1.80],
"number_observations": 74873,
"number_observations_unique": 24139,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.106
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 8.2
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.84,1.80],
"number_observations": 4058,
"number_observations_unique": 1399,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.321
},
{
"type": "R(meas)",
"value": 1.617
},
{
"type": "R(pim)",
"value": 0.920
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.385
}
]
}
]
}