Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a4307baf235bf002033af6d9c1dd5db2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 71.90,
"b": 66.04,
"c": 89.37,
"alpha": 90.0,
"beta": 98.3,
"gamma": 90.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.57,2.37],
"number_observations": 230965,
"number_observations_unique": 33894,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.161
},
{
"type": "R(meas)",
"value": 0.174
},
{
"type": "R(pim)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 10.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.43,2.37],
"number_observations": 17590,
"number_observations_unique": 2488,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.400
},
{
"type": "R(pim)",
"value": 0.567
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.552
}
]
}
]
}