Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "1939644d160e74ff8c4031b21314cd24",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.15,
"b": 93.17,
"c": 70.14,
"alpha": 90.00,
"beta": 96.38,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.73,1.4],
"number_observations_unique": 110338,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 7.5
},
{
"type": "Completeness",
"value": 95.5
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.4],
"number_observations_unique": 22781,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.648
},
{
"type": "R(meas)",
"value": 0.842
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 82.7
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.75
}
]
}
]
}