Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4ab723f398bcff7f64344b20a20f22c6",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 36.281,
"b": 60.375,
"c": 54.517,
"alpha": 90.00,
"beta": 93.42,
"gamma": 90.00
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.42,1.6],
"number_observations_unique": 30949,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 12.9
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.6],
"number_observations_unique": 1519,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.359
},
{
"type": "R(pim)",
"value": 0.224
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.875
}
]
}
]
}