Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "930a75b2c6ad143d1ed3979640d5e9d8",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 54.567,
"b": 83.132,
"c": 85.683,
"alpha": 90.000,
"beta": 97.006,
"gamma": 90.000
},
"wavelengths": [1.54301],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.67,2.0],
"number_observations_unique": 25650,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.1206
},
{
"type": "R(pim)",
"value": 0.04142
},
{
"type": "I/SigI",
"value": 10.68
},
{
"type": "Completeness",
"value": 99.01
},
{
"type": "Redundancy",
"value": 7.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.071,2.0],
"number_observations_unique": 2547,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.7084
},
{
"type": "R(meas)",
"value": 0.7727
},
{
"type": "R(pim)",
"value": 0.3046
},
{
"type": "I/SigI",
"value": 1.99
},
{
"type": "CC(1/2)",
"value": 0.927
}
]
}
]
}