Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "c50e572ca39db6ca1bce52a2edfb17d7",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 101.060,
"b": 72.116,
"c": 126.211,
"alpha": 90.00,
"beta": 101.65,
"gamma": 90.00
},
"wavelengths": [0.97935],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.112,2.40],
"number_observations_unique": 66379,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.130
},
{
"type": "R(meas)",
"value": 0.168
},
{
"type": "R(pim)",
"value": 0.106
},
{
"type": "I/SigI",
"value": 7.9
},
{
"type": "Completeness",
"value": 95.1
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [2.443,2.4],
"number_observations_unique": 3445,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.240
},
{
"type": "R(meas)",
"value": 1.619
},
{
"type": "R(pim)",
"value": 1.029
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.364
}
]
}
]
}