Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bb21b8acc072357cd66a0634c9a1b584",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 106.726,
"b": 84.471,
"c": 53.495,
"alpha": 90.000,
"beta": 105.058,
"gamma": 90.000
},
"wavelengths": [0.97857],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.82,1.63],
"number_observations_unique": 56039,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05835
},
{
"type": "R(meas)",
"value": 0.0633
},
{
"type": "R(pim)",
"value": 0.02408
},
{
"type": "I/SigI",
"value": 23.62
},
{
"type": "Completeness",
"value": 97.67
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.688,1.63],
"number_observations_unique": 4949,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5505
},
{
"type": "R(meas)",
"value": 0.6047
},
{
"type": "R(pim)",
"value": 0.2451
},
{
"type": "I/SigI",
"value": 2.00
},
{
"type": "Completeness",
"value": 85.93
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.938
}
]
}
]
}