Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "069c2f9f08b356e512b884301d22474a",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 80.74,
"b": 80.74,
"c": 178.41,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.19,2.20],
"number_observations_unique": 30831,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.0
}
]
},
"refln_shells": [
{
"resolution_limits": [2.32,2.20],
"number_observations_unique": 26665,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.544
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.1
}
]
},
{
"resolution_limits": [41.19,6.96],
"number_observations_unique": 5504,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 27.2
},
{
"type": "Completeness",
"value": 96.3
},
{
"type": "Redundancy",
"value": 5.1
}
]
}
]
}