Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4b3d659df68de2b9c4c6f6a77b864ce6",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 118.041,
"b": 71.481,
"c": 72.626,
"alpha": 90.000,
"beta": 123.178,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.79,1.75],
"number_observations_unique": 349711,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 10.9
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.75],
"number_observations_unique": 18358,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.491
},
{
"type": "I/SigI",
"value": 2.7
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.921
}
]
}
]
}