Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "91a4fd72f208de2d9e5770491eaa9339",
"space_group_name": "P 1 2 1",
"unit_cell": {
"a": 50.608,
"b": 40.174,
"c": 60.307,
"alpha": 90.00,
"beta": 101.22,
"gamma": 90.00
},
"wavelengths": [0.88560],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.17,1.41],
"number_observations_unique": 27492,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 7.0
},
{
"type": "Completeness",
"value": 88.8
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [40.17,4.50],
"number_observations_unique": 1374,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 19.7
},
{
"type": "Completeness",
"value": 92.4
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.55,1.41],
"number_observations_unique": 1375,
"quality_factors": [
{
"type": "R(pim)",
"value": 0.344
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 46.5
},
{
"type": "Redundancy",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.709
}
]
}
]
}