Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "08560b6b6453af1fd10cb385240cad57",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 170.502,
"b": 223.508,
"c": 194.943,
"alpha": 90.00,
"beta": 101.58,
"gamma": 90.00
},
"wavelengths": [0.97670],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.521,3.540],
"number_observations_unique": 86875,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.491
},
{
"type": "R(meas)",
"value": 0.531
},
{
"type": "R(pim)",
"value": 0.200
},
{
"type": "I/SigI",
"value": 5.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
},
"refln_shells": [
{
"resolution_limits": [3.600,3.540],
"number_observations": 33112,
"number_observations_unique": 4609,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.695
},
{
"type": "R(meas)",
"value": 3.984
},
{
"type": "R(pim)",
"value": 1.481
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.251
}
]
}
]
}