Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3f42fc47d64d67ab7e852790cb212298",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 52.51,
"b": 76.92,
"c": 95.92,
"alpha": 90.00,
"beta": 90.58,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.96,1.75],
"number_observations_unique": 74391,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0435
},
{
"type": "R(meas)",
"value": 0.04711
},
{
"type": "R(pim)",
"value": 0.01794
},
{
"type": "I/SigI",
"value": 28.56
},
{
"type": "Completeness",
"value": 96.64
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.813,1.750],
"number_observations_unique": 6595,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2657
},
{
"type": "R(meas)",
"value": 0.2894
},
{
"type": "R(pim)",
"value": 0.1126
},
{
"type": "I/SigI",
"value": 7.42
},
{
"type": "Completeness",
"value": 85.96
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.969
}
]
}
]
}