Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f022dc38e83002180d10446d7e164340",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 63.894,
"b": 40.570,
"c": 77.994,
"alpha": 90.00,
"beta": 111.61,
"gamma": 90.00
},
"wavelengths": [0.97872],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.0,1.42],
"number_observations_unique": 67628,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 22.8
},
{
"type": "Completeness",
"value": 96.2
},
{
"type": "Redundancy",
"value": 4.2
}
]
},
"refln_shells": [
{
"resolution_limits": [1.44,1.42],
"number_observations_unique": 3512,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.622
},
{
"type": "R(meas)",
"value": 0.726
},
{
"type": "R(pim)",
"value": 0.368
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.709
}
]
}
]
}