Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ccead011e4ce2d337442dae169116b44",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 30.987,
"b": 81.744,
"c": 32.236,
"alpha": 90.000,
"beta": 118.205,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.810,1.498],
"number_observations": 70606,
"number_observations_unique": 21524,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.162
},
{
"type": "I/SigI",
"value": 8.4
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
"refln_shells": [
{
"resolution_limits": [1.503,1.498],
"number_observations": 674,
"number_observations_unique": 203,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.373
},
{
"type": "Completeness",
"value": 93.500
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [40.810,6.943],
"number_observations": 789,
"number_observations_unique": 242,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 3.300
}
]
}
]
}