Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ed4e803f2cd24e6e794024b31c74f58d",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 79.610,
"b": 79.814,
"c": 89.346,
"alpha": 90.00,
"beta": 106.42,
"gamma": 90.00
},
"wavelengths": [1.00001],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.8500,2.2],
"number_observations_unique": 27135,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 13.0
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.28,2.2],
"number_observations_unique": 2175,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.269
},
{
"type": "R(meas)",
"value": 1.369
},
{
"type": "R(pim)",
"value": 0.717
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "CC(1/2)",
"value": 0.699
}
]
}
]
}