Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1ec6e83febc84cd7a0f5e3e5bc9c2b15",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.588,
"b": 41.724,
"c": 72.651,
"alpha": 90.00,
"beta": 104.54,
"gamma": 90.00
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.724,1.127],
"number_observations_unique": 91331,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 11.3
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 3.67
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.20,1.13],
"number_observations_unique": 14083,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.492
},
{
"type": "I/SigI",
"value": 2.04
},
{
"type": "Completeness",
"value": 94.1
},
{
"type": "Redundancy",
"value": 3.46
},
{
"type": "CC(1/2)",
"value": 0.839
}
]
}
]
}