Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cdcba9658b7f669de67c26e6a0be4eb4",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 152.743,
"b": 89.185,
"c": 98.424,
"alpha": 90.000,
"beta": 112.314,
"gamma": 90.000
},
"wavelengths": [0.96770],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [91.054,2.60],
"number_observations_unique": 37215,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 10.6
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.72,2.60],
"number_observations_unique": 4577,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.665
},
{
"type": "R(meas)",
"value": 0.933
},
{
"type": "R(pim)",
"value": 0.653
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.682
}
]
}
]
}