Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "c848fd0bb209a815983387adee6d2456",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.132,
"b": 41.080,
"c": 72.277,
"alpha": 90.00,
"beta": 104.42,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.00,1.12],
"number_observations": 592353,
"number_observations_unique": 89732,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "R(meas)",
"value": 0.119
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 12.8
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [1.14,1.12],
"number_observations": 12567,
"number_observations_unique": 3031,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.324
},
{
"type": "R(meas)",
"value": 0.367
},
{
"type": "R(pim)",
"value": 0.167
},
{
"type": "I/SigI",
"value": 3.5
},
{
"type": "Redundancy",
"value": 4.1
},
{
"type": "CC(1/2)",
"value": 0.913
}
]
}
]
}