Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "458b9a2c9c52e3fe8a3e5c1c933f1447",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 120.678,
"b": 60.376,
"c": 64.562,
"alpha": 90.00,
"beta": 95.78,
"gamma": 90.00
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.260,1.840],
"number_observations": 271483,
"number_observations_unique": 40163,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.09137
},
{
"type": "R(meas)",
"value": 0.09928
},
{
"type": "R(pim)",
"value": 0.03835
},
{
"type": "I/SigI",
"value": 13.08
},
{
"type": "Completeness",
"value": 99.81
},
{
"type": "Redundancy",
"value": 3.469
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.860,1.840],
"number_observations_unique": 3984,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.9103
},
{
"type": "R(meas)",
"value": 0.9831
},
{
"type": "R(pim)",
"value": 0.368
},
{
"type": "I/SigI",
"value": 3.53
},
{
"type": "Completeness",
"value": 99.95
},
{
"type": "Redundancy",
"value": 3.602
},
{
"type": "CC(1/2)",
"value": 0.866
}
]
}
]
}