Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3c59e4dd68a8865c39a54a284c0ced55",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 180.686,
"b": 55.588,
"c": 138.668,
"alpha": 90.000,
"beta": 127.452,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.17,2.53],
"number_observations": 249415,
"number_observations_unique": 36870,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.443
},
{
"type": "R(meas)",
"value": 0.480
},
{
"type": "R(pim)",
"value": 0.183
},
{
"type": "I/SigI",
"value": 4.7
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.966
}
]
},
"refln_shells": [
{
"resolution_limits": [2.64,2.53],
"number_observations": 31050,
"number_observations_unique": 4446,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.534
},
{
"type": "R(meas)",
"value": 3.817
},
{
"type": "R(pim)",
"value": 1.428
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.210
}
]
}
]
}