Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "97292fef8876aa0394c017f5e44c52df",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 111.949,
"b": 52.750,
"c": 44.337,
"alpha": 90.00,
"beta": 102.85,
"gamma": 90.00
},
"wavelengths": [0.91259],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.57,1.66],
"number_observations": 90003,
"number_observations_unique": 29537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.69,1.66],
"number_observations": 3577,
"number_observations_unique": 1424,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.180
},
{
"type": "R(meas)",
"value": 1.496
},
{
"type": "R(pim)",
"value": 0.905
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.260
}
]
}
]
}