Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "251920f61eedc4e06127c58c1de4e69d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 53.139,
"b": 76.670,
"c": 67.988,
"alpha": 90.000,
"beta": 102.053,
"gamma": 90.000
},
"wavelengths": [0.97951],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [76.67,1.80],
"number_observations_unique": 49541,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.207
},
{
"type": "R(pim)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.84,1.80],
"number_observations_unique": 2966,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.351
},
{
"type": "R(pim)",
"value": 1.301
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.506
}
]
}
]
}