Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "124e66c849daa2f813f32029d3955e0f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.553,
"b": 61.704,
"c": 32.693,
"alpha": 90.00,
"beta": 92.67,
"gamma": 90.00
},
"wavelengths": [0.92204],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.97,1.75],
"number_observations": 99371,
"number_observations_unique": 14484,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.225
},
{
"type": "R(meas)",
"value": 0.244
},
{
"type": "R(pim)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.79,1.75],
"number_observations": 4871,
"number_observations_unique": 761,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.229
},
{
"type": "R(meas)",
"value": 2.433
},
{
"type": "R(pim)",
"value": 0.963
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.174
}
]
}
]
}