Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3ebf3d0be505a28e0ce75a3264622f59",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 57.39,
"b": 42.56,
"c": 76.47,
"alpha": 90.0,
"beta": 108.3,
"gamma": 90.0
},
"wavelengths": [0.97800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.49,1.13],
"number_observations_unique": 128873,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 17.5
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 20.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.16,1.13],
"number_observations_unique": 8881,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.717
},
{
"type": "R(pim)",
"value": 0.457
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 91.7
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.657
}
]
}
]
}