Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "410e58f331d3352530918eee29851c01",
"space_group_name": "I 4 2 2",
"unit_cell": {
"a": 148.42,
"b": 148.42,
"c": 304.67,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.830,3.000],
"number_observations": 507888,
"number_observations_unique": 34477,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.381
},
{
"type": "R(pim)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 6.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [3.150,3.000],
"number_observations": 67858,
"number_observations_unique": 4522,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.912
},
{
"type": "R(pim)",
"value": 1.307
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.000
},
{
"type": "CC(1/2)",
"value": 0.408
}
]
},
{
"resolution_limits": [48.830,9.950],
"number_observations": 13969,
"number_observations_unique": 1057,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 42.200
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 13.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}