Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "de0bc8e74c94c2c7e4276b9f4754ef47",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.67,
"b": 92.66,
"c": 66.77,
"alpha": 90.00,
"beta": 110.47,
"gamma": 90.00
},
"wavelengths": [1.12000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [62.55,1.60],
"number_observations_unique": 510902,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1141
},
{
"type": "R(meas)",
"value": 0.1237
},
{
"type": "R(pim)",
"value": 0.04718
},
{
"type": "I/SigI",
"value": 12.66
},
{
"type": "Completeness",
"value": 99.92
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.662,1.60],
"number_observations_unique": 7504,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.045
},
{
"type": "R(meas)",
"value": 1.142
},
{
"type": "R(pim)",
"value": 0.4542
},
{
"type": "I/SigI",
"value": 1.62
},
{
"type": "Completeness",
"value": 99.93
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.603
}
]
}
]
}