Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "01c2a6fa1a4fed5a99cd33b9720b8a28",
"space_group_name": "P 1",
"unit_cell": {
"a": 39.817,
"b": 49.090,
"c": 57.385,
"alpha": 83.84,
"beta": 88.82,
"gamma": 89.68
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [57.04,1.94],
"number_observations_unique": 30888,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1901
},
{
"type": "R(meas)",
"value": 0.2027
},
{
"type": "R(pim)",
"value": 0.06938
},
{
"type": "I/SigI",
"value": 6.33
},
{
"type": "Completeness",
"value": 96.2
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.009,1.94],
"number_observations_unique": 2931,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.506
},
{
"type": "R(meas)",
"value": 1.642
},
{
"type": "R(pim)",
"value": 0.6427
},
{
"type": "I/SigI",
"value": 3.17
},
{
"type": "Completeness",
"value": 91.25
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.586
}
]
}
]
}