Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b42028fa1d0546a1eebc8cb7ed131dac",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 39.206,
"b": 179.450,
"c": 139.670,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96770],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.830,1.845],
"number_observations_unique": 31795,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.29
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 89.6
},
{
"type": "Redundancy",
"value": 8.2
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.03,1.845],
"number_observations_unique": 1590,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.8
},
{
"type": "Completeness",
"value": 33.9
},
{
"type": "Redundancy",
"value": 8.8
},
{
"type": "CC(1/2)",
"value": 0.327
}
]
}
]
}