Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dd35b0faaf3d0881fe8d53661285b0cd",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.115,
"b": 40.977,
"c": 111.038,
"alpha": 90.00,
"beta": 92.53,
"gamma": 90.00
},
"wavelengths": [0.95400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.07,2.16],
"number_observations_unique": 22601,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.179
},
{
"type": "R(meas)",
"value": 0.193
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 9.5
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.23,2.16],
"number_observations_unique": 1945,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.866
},
{
"type": "R(meas)",
"value": 0.940
},
{
"type": "R(pim)",
"value": 0.359
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.715
}
]
}
]
}