Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "55bf10b3e143636df0e7240e56919401",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 85.345,
"b": 57.746,
"c": 32.541,
"alpha": 90.0,
"beta": 92.2,
"gamma": 90.0
},
"wavelengths": [0.94054],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.82,1.72],
"number_observations": 112858,
"number_observations_unique": 16515,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.201
},
{
"type": "R(meas)",
"value": 0.218
},
{
"type": "R(pim)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.75,1.72],
"number_observations": 5134,
"number_observations_unique": 771,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.878
},
{
"type": "R(meas)",
"value": 4.208
},
{
"type": "R(pim)",
"value": 1.612
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.140
}
]
}
]
}