Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8913d2cf37a9045ff69ab4b65c22b37c",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 111.106,
"b": 61.570,
"c": 79.511,
"alpha": 90.000,
"beta": 112.685,
"gamma": 90.000
},
"wavelengths": [1.07216],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.78,2.81],
"number_observations_unique": 7956,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(meas)",
"value": 0.163
},
{
"type": "R(pim)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 5.7
},
{
"type": "Completeness",
"value": 89.9
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [3.11,2.81],
"number_observations_unique": 398,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.916
},
{
"type": "R(meas)",
"value": 1.077
},
{
"type": "R(pim)",
"value": 0.56
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 59.8
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.501
}
]
}
]
}