Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e4e63cc73b971c33d6fff8849df4866b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 77.458,
"b": 74.097,
"c": 91.600,
"alpha": 90.00,
"beta": 108.94,
"gamma": 90.00
},
"wavelengths": [0.90500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [86.64,1.12],
"number_observations_unique": 361487,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 97.0
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.14,1.12],
"number_observations_unique": 9301,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.951
},
{
"type": "R(meas)",
"value": 1.234
},
{
"type": "R(pim)",
"value": 0.773
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Completeness",
"value": 50.7
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.449
}
]
}
]
}