Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "1c9b6d57d7d52cff3d9ebcc8c6a0819b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 44.427,
"b": 59.212,
"c": 78.732,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97893],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.32,1.30],
"number_observations_unique": 51734,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 17.2
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.32,1.3],
"number_observations_unique": 2443,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.004
},
{
"type": "R(meas)",
"value": 1.117
},
{
"type": "R(pim)",
"value": 0.479
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.567
}
]
}
]
}