Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "32e4e9e19d9e4c0221faa39f9e5dc9d5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 106.045,
"b": 101.561,
"c": 56.667,
"alpha": 90.000,
"beta": 122.353,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.80],
"number_observations_unique": 46455,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 20.8
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.86,1.80],
"number_observations_unique": 4286,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.250
},
{
"type": "R(pim)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
}
]
}