Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1e79ac8aebb79b1034e1ff94bbfc8acb",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 214.550,
"b": 105.838,
"c": 101.403,
"alpha": 90.000,
"beta": 101.038,
"gamma": 90.000
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40,3.7],
"number_observations_unique": 22957,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.211
},
{
"type": "R(meas)",
"value": 0.248
},
{
"type": "R(pim)",
"value": 0.128
},
{
"type": "I/SigI",
"value": 5.4
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
"refln_shells": [
{
"resolution_limits": [4,3.7],
"number_observations_unique": 4468,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.735
},
{
"type": "R(meas)",
"value": 0.866
},
{
"type": "R(pim)",
"value": 0.451
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 92.1
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.71
}
]
}
]
}