Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b1c3c0835fe430f33682fc6e8aa806b8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.685,
"b": 51.485,
"c": 53.112,
"alpha": 90.000,
"beta": 91.016,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.7,1.23],
"number_observations_unique": 68247,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 8.8
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.25,1.23],
"number_observations_unique": 3276,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.781
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 95.4
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.835
}
]
}
]
}