Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e52fa46640580eae9fe2d50772e1e097",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 37.620,
"b": 43.171,
"c": 79.418,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91163],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.71,1.16],
"number_observations_unique": 45643,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 8.9
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 12.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [39.71,6.35],
"number_observations_unique": 343,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "Redundancy",
"value": 10.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [1.18,1.16],
"number_observations_unique": 2218,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.685
},
{
"type": "R(meas)",
"value": 6.172
},
{
"type": "R(pim)",
"value": 2.384
},
{
"type": "Redundancy",
"value": 12.8
},
{
"type": "CC(1/2)",
"value": 0.398
}
]
}
]
}