Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "57a656f38b2f3e3b952b90b39afb27a0",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 97.418,
"b": 45.876,
"c": 72.248,
"alpha": 90.000,
"beta": 104.971,
"gamma": 90.000
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.41,2.16],
"number_observations_unique": 16461,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.306
},
{
"type": "R(meas)",
"value": 0.331
},
{
"type": "R(pim)",
"value": 0.123
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.977
}
]
},
"refln_shells": [
{
"resolution_limits": [2.20,2.16],
"number_observations_unique": 706,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.932
},
{
"type": "R(meas)",
"value": 1.2
},
{
"type": "R(pim)",
"value": 0.676
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 85.4
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.285
}
]
}
]
}