Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "27cbb4b912ecb9ff40b6670e6447e9ba",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 162.150,
"b": 68.750,
"c": 77.595,
"alpha": 90.00,
"beta": 117.43,
"gamma": 90.00
},
"wavelengths": [0.96707],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.12,2.37],
"number_observations_unique": 29995,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.09008
},
{
"type": "R(meas)",
"value": 0.1007
},
{
"type": "R(pim)",
"value": 0.04406
},
{
"type": "I/SigI",
"value": 8.32
},
{
"type": "Completeness",
"value": 96.72
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.455,2.37],
"number_observations_unique": 2636,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.4751
},
{
"type": "R(meas)",
"value": 0.5507
},
{
"type": "R(pim)",
"value": 0.2696
},
{
"type": "I/SigI",
"value": 1.54
},
{
"type": "Completeness",
"value": 85.80
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.821
}
]
}
]
}