Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e0e4b2953b632bb73d71b2de91aa3054",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 72.694,
"b": 188.955,
"c": 95.056,
"alpha": 90.00,
"beta": 107.62,
"gamma": 90.00
},
"wavelengths": [1.00003],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.8],
"number_observations_unique": 81985,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 17.4
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.85,2.80],
"number_observations_unique": 2849,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.374
},
{
"type": "R(meas)",
"value": 0.369
},
{
"type": "R(pim)",
"value": 0.198
},
{
"type": "I/SigI",
"value": 4.4
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.826
}
]
}
]
}