Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "03f58a3ae11a3290c9ce87adc4641e92",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 53.65,
"b": 80.44,
"c": 72.31,
"alpha": 90.00,
"beta": 94.75,
"gamma": 90.00
},
"wavelengths": [0.96770],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.75,2.66],
"number_observations_unique": 17555,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 5.7
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.79,2.66],
"number_observations_unique": 2355,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.327
},
{
"type": "R(meas)",
"value": 0.408
},
{
"type": "R(pim)",
"value": 0.240
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.932
}
]
}
]
}