Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8e123d5f935769e661b66ad56a38ba3b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 69.085,
"b": 79.399,
"c": 34.266,
"alpha": 90.00,
"beta": 107.42,
"gamma": 90.00
},
"wavelengths": [0.95400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.70,1.75],
"number_observations_unique": 17742,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.75],
"number_observations_unique": 899,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.636
},
{
"type": "R(meas)",
"value": 0.691
},
{
"type": "R(pim)",
"value": 0.267
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 93.3
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.869
}
]
}
]
}