Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "38044258c3e837f2bc5bed034b3dff3a",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 101.678,
"b": 110.021,
"c": 75.755,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.78,1.32],
"number_observations_unique": 146042,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "R(meas)",
"value": 0.220
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 9.8
},
{
"type": "Completeness",
"value": 94.1
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.49,1.32],
"number_observations_unique": 7306,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.50
},
{
"type": "R(meas)",
"value": 2.742
},
{
"type": "R(pim)",
"value": 0.789
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 55.6
},
{
"type": "Redundancy",
"value": 11.6
},
{
"type": "CC(1/2)",
"value": 0.331
}
]
}
]
}