Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1987917052d2ca773602a714ddff6a9d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 118.746,
"b": 37.709,
"c": 28.490,
"alpha": 90.0,
"beta": 92.5,
"gamma": 90.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [27.29,1.40],
"number_observations": 222985,
"number_observations_unique": 24826,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.090
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 13.4
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 9.0
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.40],
"number_observations": 6098,
"number_observations_unique": 1205,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.836
},
{
"type": "R(meas)",
"value": 0.925
},
{
"type": "R(pim)",
"value": 0.380
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.675
}
]
}
]
}