Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ec848edd914e840f31f208db6cc88c0e",
"space_group_name": "P 1",
"unit_cell": {
"a": 45.117,
"b": 46.893,
"c": 80.173,
"alpha": 103.083,
"beta": 98.536,
"gamma": 108.512
},
"wavelengths": [0.97857],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.54,1.4],
"number_observations_unique": 115240,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 16.1
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.4],
"number_observations_unique": 5620,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.300
},
{
"type": "R(pim)",
"value": 0.236
},
{
"type": "I/SigI",
"value": 3.1
},
{
"type": "Completeness",
"value": 96.4
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.0963
}
]
}
]
}