Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "98bcd1af84ea1c353c51d95fb7ae36c0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 31.426,
"b": 91.466,
"c": 64.392,
"alpha": 90.000,
"beta": 90.019,
"gamma": 90.000
},
"wavelengths": [0.97893],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.73,1.25],
"number_observations_unique": 97592,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.02
},
{
"type": "I/SigI",
"value": 24.1
},
{
"type": "Completeness",
"value": 97.3
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.27,1.25],
"number_observations_unique": 3705,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2
},
{
"type": "R(meas)",
"value": 0.227
},
{
"type": "R(pim)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 5.8
},
{
"type": "Completeness",
"value": 75.1
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.916
}
]
}
]
}