Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1e1cb29c724df39349c5aa2fd6a422d5",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 93.034,
"b": 80.131,
"c": 116.189,
"alpha": 90.00,
"beta": 90.13,
"gamma": 90.00
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.23,1.78],
"number_observations": 1115757,
"number_observations_unique": 163324,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 12.6
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.83,1.78],
"number_observations": 83689,
"number_observations_unique": 11978,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.136
},
{
"type": "R(meas)",
"value": 1.228
},
{
"type": "R(pim)",
"value": 0.462
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.787
}
]
}
]
}