Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "30c2852b0a3167c907ca1792e3ef3ff8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 41.985,
"b": 41.414,
"c": 72.309,
"alpha": 90.000,
"beta": 103.968,
"gamma": 90.000
},
"wavelengths": [0.95366],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.4,1.21],
"number_observations_unique": 70793,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 12.4
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.24,1.21],
"number_observations_unique": 3003,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.779
},
{
"type": "R(pim)",
"value": 0.326
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 83.5
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.736
}
]
}
]
}