Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3d2e42ec32cbd7a8c3a5e30ffd9d26eb",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 85.860,
"b": 102.201,
"c": 177.300,
"alpha": 90.00,
"beta": 93.96,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.65,2.13],
"number_observations_unique": 88737,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 8.0
},
{
"type": "Completeness",
"value": 99.56
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.14,2.1],
"number_observations_unique": 4518,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.539
},
{
"type": "R(meas)",
"value": 0.650
},
{
"type": "R(pim)",
"value": 0.358
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.800
}
]
}
]
}