Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fc72dff1c6c071ab2b0067fe6ebfac04",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 71.851,
"b": 191.468,
"c": 97.025,
"alpha": 90.0,
"beta": 109.5,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.900,4.000],
"number_observations": 72521,
"number_observations_unique": 20792,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "R(meas)",
"value": 0.146
},
{
"type": "R(pim)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 8.000
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [4.380,4.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.665
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.796
}
]
},
{
"resolution_limits": [35.900,9.800],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}