Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1e9ead29bfa1b28dd0c70a10f5399e02",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 98.591,
"b": 81.299,
"c": 51.859,
"alpha": 90.00,
"beta": 114.62,
"gamma": 90.00
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.5,1.60],
"number_observations_unique": 48121,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 26.3
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.60],
"number_observations_unique": 2341,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.877
},
{
"type": "R(meas)",
"value": 1.111
},
{
"type": "R(pim)",
"value": 0.672
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 95.4
},
{
"type": "Redundancy",
"value": 2.3
},
{
"type": "CC(1/2)",
"value": 0.354
}
]
}
]
}