Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "32e0b3e1fd2e2bda96def84a4fc48c7f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 119.337,
"b": 105.597,
"c": 64.861,
"alpha": 90.000,
"beta": 93.651,
"gamma": 90.000
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.3,2.65],
"number_observations_unique": 23086,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1165
},
{
"type": "R(meas)",
"value": 0.1391
},
{
"type": "R(pim)",
"value": 0.0750
},
{
"type": "I/SigI",
"value": 8.03
},
{
"type": "Completeness",
"value": 98.56
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.75,2.65],
"number_observations_unique": 2244,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.7036
},
{
"type": "R(meas)",
"value": 0.8407
},
{
"type": "R(pim)",
"value": 0.4547
},
{
"type": "I/SigI",
"value": 1.56
},
{
"type": "Completeness",
"value": 96.39
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.640
}
]
}
]
}