Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5032879a8fbe4e2e59b50de648b1fb7c",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 50.062,
"b": 76.165,
"c": 109.226,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.51,1.77],
"number_observations_unique": 41529,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 14.9
},
{
"type": "Completeness",
"value": 99.84
},
{
"type": "Redundancy",
"value": 12.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.81,1.77],
"number_observations_unique": 2329,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.414
},
{
"type": "R(pim)",
"value": 0.7
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 12.7
},
{
"type": "CC(1/2)",
"value": 0.511
}
]
}
]
}