Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3e3b6815e0c2352ad99c69f68d20a5d1",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 53.231,
"b": 107.811,
"c": 117.998,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.520,2.790],
"number_observations_unique": 17235,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 16.800
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.940,2.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.382
},
{
"type": "Completeness",
"value": 93.200
},
{
"type": "Redundancy",
"value": 6.700
}
]
}
]
}