Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "095d7378e971d8a2d39561e0117d65bd",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.240,
"b": 41.385,
"c": 71.965,
"alpha": 90.00,
"beta": 104.12,
"gamma": 90.00
},
"wavelengths": [0.97934],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,1.20],
"number_observations_unique": 72177,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 35.1
},
{
"type": "Completeness",
"value": 95.5
},
{
"type": "Redundancy",
"value": 7.6
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations_unique": 3480,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.226
},
{
"type": "R(meas)",
"value": 0.242
},
{
"type": "R(pim)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 92.7
},
{
"type": "Redundancy",
"value": 7.7
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
}
]
}