Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "304c2b3d802f245f301e66a89f055212",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.202,
"b": 111.216,
"c": 150.589,
"alpha": 90.00,
"beta": 93.21,
"gamma": 90.00
},
"wavelengths": [0.96770],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.274,2.688],
"number_observations_unique": 52817,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.208
},
{
"type": "R(meas)",
"value": 0.225
},
{
"type": "R(pim)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 9.6
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [2.74,2.69],
"number_observations_unique": 2664,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.17
},
{
"type": "R(meas)",
"value": 1.262
},
{
"type": "R(pim)",
"value": 0.469
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.590
}
]
}
]
}