Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7990b14086381647e8e7434ab313ccc3",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 127.244,
"b": 84.784,
"c": 87.860,
"alpha": 90.00,
"beta": 131.09,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.230,1.330],
"number_observations": 657654,
"number_observations_unique": 120155,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 16.600
},
{
"type": "Completeness",
"value": 80.300
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.35,1.33],
"number_observations": 40069,
"number_observations_unique": 2016,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.140
},
{
"type": "R(meas)",
"value": 1.497
},
{
"type": "R(pim)",
"value": 0.955
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Completeness",
"value": 13.5
},
{
"type": "Redundancy",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.244
}
]
}
]
}