Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f0e4a1b10678b875a0f3e96cf65f7266",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 89.362,
"b": 64.020,
"c": 45.987,
"alpha": 90.00,
"beta": 109.54,
"gamma": 90.00
},
"wavelengths": [0.90000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.02,1.05],
"number_observations_unique": 108442,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 14.9
},
{
"type": "Completeness",
"value": 95.8
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.07,1.05],
"number_observations_unique": 5112,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.576
},
{
"type": "R(meas)",
"value": 0.676
},
{
"type": "R(pim)",
"value": 0.352
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.760
}
]
}
]
}