Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7494807b6174c2b9ee5c61884b2d1ad0",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 48.628,
"b": 48.628,
"c": 194.979,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.74,2.05],
"number_observations_unique": 17740,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.186
},
{
"type": "R(meas)",
"value": 0.204
},
{
"type": "R(pim)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 10.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [48.74,8.94],
"number_observations_unique": 283,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 29.3
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 7.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [2.11,2.05],
"number_observations_unique": 1361,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.764
},
{
"type": "R(meas)",
"value": 1.934
},
{
"type": "R(pim)",
"value": 0.790
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 0.661
}
]
}
]
}