Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e5e5a1bdec59e0dd9bdcfb022860b9df",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 60.61,
"b": 78.37,
"c": 127.00,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.30,1.42],
"number_observations_unique": 113330,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1395
},
{
"type": "R(meas)",
"value": 0.1454
},
{
"type": "R(pim)",
"value": 0.04049
},
{
"type": "I/SigI",
"value": 14.23
},
{
"type": "Completeness",
"value": 98.78
},
{
"type": "Redundancy",
"value": 12.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.47,1.42],
"number_observations_unique": 11043,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.455
},
{
"type": "R(meas)",
"value": 1.512
},
{
"type": "R(pim)",
"value": 0.4061
},
{
"type": "I/SigI",
"value": 2.04
},
{
"type": "Completeness",
"value": 97.43
},
{
"type": "Redundancy",
"value": 13.4
},
{
"type": "CC(1/2)",
"value": 0.764
}
]
}
]
}