Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "87a8251167b110cf84ba7ffc8f43a18e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 126.929,
"b": 84.820,
"c": 87.927,
"alpha": 90.00,
"beta": 130.84,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.500,1.310],
"number_observations": 756921,
"number_observations_unique": 120126,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.099
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 12.000
},
{
"type": "Completeness",
"value": 85.100
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.33,1.31],
"number_observations": 30848,
"number_observations_unique": 792,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.457
},
{
"type": "R(meas)",
"value": 0.640
},
{
"type": "R(pim)",
"value": 0.447
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 7.27
},
{
"type": "Redundancy",
"value": 1.3
},
{
"type": "CC(1/2)",
"value": 0.619
}
]
}
]
}