Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b16b707ca9ed1954e94c2bef68646ad0",
"space_group_name": "P 1",
"unit_cell": {
"a": 46.603,
"b": 47.166,
"c": 68.458,
"alpha": 88.20,
"beta": 89.69,
"gamma": 75.09
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40,1.26],
"number_observations_unique": 142958,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 21.1
},
{
"type": "Completeness",
"value": 93.9
},
{
"type": "Redundancy",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.935
}
]
},
"refln_shells": [
{
"resolution_limits": [1.28,1.26],
"number_observations_unique": 6226,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.245
},
{
"type": "R(meas)",
"value": 0.245
},
{
"type": "R(pim)",
"value": 0.164
},
{
"type": "I/SigI",
"value": 4.2
},
{
"type": "Completeness",
"value": 82.3
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.927
}
]
}
]
}