Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "29f555cde713f606d1044b5281448a04",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.408,
"b": 32.153,
"c": 60.426,
"alpha": 90.00,
"beta": 101.92,
"gamma": 90.00
},
"wavelengths": [0.87310],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.12,1.25],
"number_observations_unique": 38945,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 20.8
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.27,1.25],
"number_observations_unique": 1813,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.257
},
{
"type": "R(meas)",
"value": 0.288
},
{
"type": "R(pim)",
"value": 0.128
},
{
"type": "I/SigI",
"value": 5.5
},
{
"type": "Completeness",
"value": 94.9
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.949
}
]
}
]
}