Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f72beb39a592d65822244cbfb0ee0712",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 47.503,
"b": 85.171,
"c": 90.432,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.12713],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.59,1.599],
"number_observations_unique": 49166,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1004
},
{
"type": "I/SigI",
"value": 11.56
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.656,1.599],
"number_observations_unique": 4788,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.7938
},
{
"type": "I/SigI",
"value": 1.98
},
{
"type": "Completeness",
"value": 98.84
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.894
}
]
}
]
}