Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9479188b5841eed956dc9e5772f0fd65",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.990,
"b": 53.564,
"c": 44.445,
"alpha": 90.00,
"beta": 101.08,
"gamma": 90.00
},
"wavelengths": [0.91258],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.93,1.58],
"number_observations": 106364,
"number_observations_unique": 35781,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 9.4
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.61,1.58],
"number_observations": 4132,
"number_observations_unique": 1728,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.062
},
{
"type": "R(meas)",
"value": 1.346
},
{
"type": "R(pim)",
"value": 0.818
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.331
}
]
}
]
}