Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fda2fad04586769c7231fd59f3b9f47e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.056,
"b": 168.117,
"c": 45.424,
"alpha": 90.000,
"beta": 105.551,
"gamma": 90.000
},
"wavelengths": [2.70000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.35,1.50],
"number_observations_unique": 84735,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 19.1
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.50],
"number_observations_unique": 4091,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.239
},
{
"type": "R(meas)",
"value": 0.322
},
{
"type": "R(pim)",
"value": 0.215
},
{
"type": "I/SigI",
"value": 4.4
},
{
"type": "Completeness",
"value": 96.3
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.913
}
]
}
]
}