Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "9f5a3a9ffa9f21e40c949423d4e4aa5b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.777,
"b": 212.066,
"c": 77.438,
"alpha": 90.00,
"beta": 106.02,
"gamma": 90.00
},
"wavelengths": [0.97933],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.22,2.3],
"number_observations_unique": 66610,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 13.7
},
{
"type": "Completeness",
"value": 95.7
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.307,2.3],
"number_observations_unique": 643,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.493
},
{
"type": "R(meas)",
"value": 0.552
},
{
"type": "R(pim)",
"value": 0.241
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 90.6
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.884
}
]
}
]
}