Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b2ea0bf4937e18b54cb7bd6c4dd00f64",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.49,
"b": 51.83,
"c": 64.56,
"alpha": 90.000,
"beta": 110.427,
"gamma": 90.000
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.92,1.67],
"number_observations_unique": 32027,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.181
},
{
"type": "R(meas)",
"value": 0.198
},
{
"type": "R(pim)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 6.6
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.70,1.67],
"number_observations_unique": 1580,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.556
},
{
"type": "R(meas)",
"value": 2.784
},
{
"type": "R(pim)",
"value": 1.095
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.341
}
]
}
]
}