Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4febd730e36bc2b13bca40b485517613",
"space_group_name": "I 2 3",
"unit_cell": {
"a": 187.458,
"b": 187.458,
"c": 187.458,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [93.73,2.96],
"number_observations_unique": 22975,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 17.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 10.7
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [3.04,2.96],
"number_observations_unique": 1690,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.713
},
{
"type": "R(meas)",
"value": 1.799
},
{
"type": "R(pim)",
"value": 0.545
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "CC(1/2)",
"value": 0.533
}
]
}
]
}