Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "55893673971c7fe643e52195bf98efbc",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 109.114,
"b": 145.029,
"c": 191.895,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.48,3.35],
"number_observations": 1025053,
"number_observations_unique": 44026,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.283
},
{
"type": "R(meas)",
"value": 0.289
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 9.8
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 23.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [3.48,3.35],
"number_observations": 81974,
"number_observations_unique": 4613,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.452
},
{
"type": "R(meas)",
"value": 4.586
},
{
"type": "R(pim)",
"value": 1.077
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 17.8
},
{
"type": "CC(1/2)",
"value": 0.280
}
]
}
]
}