Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8c55e4a8ef035589e9c7aeac14dd6296",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 54.079,
"b": 70.669,
"c": 77.717,
"alpha": 90.00,
"beta": 101.13,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.8,1.53],
"number_observations_unique": 85118,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 12.5
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.56,1.53],
"number_observations_unique": 1968,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.314
},
{
"type": "R(meas)",
"value": 0.350
},
{
"type": "R(pim)",
"value": 0.152
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 81.7
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.941
}
]
}
]
}