Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f3d5172d37e061e5f849be1e610adb74",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.768,
"b": 61.968,
"c": 32.825,
"alpha": 90.00,
"beta": 93.12,
"gamma": 90.00
},
"wavelengths": [0.92209],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.33,1.54],
"number_observations": 112819,
"number_observations_unique": 20193,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "R(meas)",
"value": 0.116
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 7.8
},
{
"type": "Completeness",
"value": 93.0
},
{
"type": "Redundancy",
"value": 5.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.62,1.54],
"number_observations": 7876,
"number_observations_unique": 2381,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.204
},
{
"type": "R(meas)",
"value": 1.408
},
{
"type": "R(pim)",
"value": 0.704
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.446
}
]
}
]
}