Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6639fc0dfcdf0cc7a1b5ee16e2b0be11",
"space_group_name": "P 1",
"unit_cell": {
"a": 21.094,
"b": 26.974,
"c": 38.844,
"alpha": 106.555,
"beta": 96.898,
"gamma": 91.600
},
"wavelengths": [1.28300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.9,1.60],
"number_observations_unique": 18254,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 6.00
},
{
"type": "Completeness",
"value": 85.4
},
{
"type": "Redundancy",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.70,1.60],
"number_observations_unique": 2739,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.472
},
{
"type": "R(meas)",
"value": 0.668
},
{
"type": "I/SigI",
"value": 1.21
},
{
"type": "CC(1/2)",
"value": 0.866
}
]
}
]
}