Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "783e9c8242ffac102c1bb591542f2d11",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.120,
"b": 103.312,
"c": 52.377,
"alpha": 90.00,
"beta": 112.49,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,1.78],
"number_observations_unique": 25202,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 10.9
},
{
"type": "Completeness",
"value": 96.6
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.81,1.78],
"number_observations_unique": 2064,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.428
},
{
"type": "R(meas)",
"value": 0.515
},
{
"type": "R(pim)",
"value": 0.283
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.868
}
]
}
]
}