Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2e989cb0a1dbe879f8fc737fbbff38c2",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 57.225,
"b": 73.956,
"c": 115.120,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97242],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.420,2.000],
"number_observations": 325593,
"number_observations_unique": 33564,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 17.500
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 9.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"number_observations_unique": 2391,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.596
},
{
"type": "R(meas)",
"value": 1.686
},
{
"type": "R(pim)",
"value": 0.534
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 9.600
},
{
"type": "CC(1/2)",
"value": 0.724
}
]
},
{
"resolution_limits": [45.420,8.930],
"number_observations_unique": 447,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 8.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}