Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "43e0e367fc1862bec9bcc37173df6c7d",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 46.344,
"b": 70.664,
"c": 146.349,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.75,1.93],
"number_observations_unique": 17297,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "R(meas)",
"value": 0.166
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 12.29
},
{
"type": "Completeness",
"value": 93.41
},
{
"type": "Redundancy",
"value": 13.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.999,1.93],
"number_observations_unique": 1563,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.303
},
{
"type": "R(meas)",
"value": 1.358
},
{
"type": "R(pim)",
"value": 0.376
},
{
"type": "I/SigI",
"value": 2.07
},
{
"type": "Completeness",
"value": 85.81
},
{
"type": "Redundancy",
"value": 12.3
},
{
"type": "CC(1/2)",
"value": 0.711
}
]
}
]
}