Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b2fbfce229cc880aef631338850b9029",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.620,
"b": 53.287,
"c": 44.962,
"alpha": 90.00,
"beta": 101.98,
"gamma": 90.00
},
"wavelengths": [0.91261],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.55,1.80],
"number_observations": 76974,
"number_observations_unique": 24420,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 6.6
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.84,1.80],
"number_observations": 4720,
"number_observations_unique": 1443,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.706
},
{
"type": "R(meas)",
"value": 2.046
},
{
"type": "R(pim)",
"value": 1.117
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.327
}
]
}
]
}