Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "30861219a1410b6b6a6a237cdc6e4b04",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 171.600,
"b": 171.600,
"c": 167.526,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.54,3.50],
"number_observations_unique": 36362,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.222
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 12.7
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 20.1
},
{
"type": "CC(1/2)",
"value": 0.98
}
]
},
"refln_shells": [
{
"resolution_limits": [3.66,3.50],
"number_observations_unique": 4377,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.314
},
{
"type": "R(pim)",
"value": 1.049
},
{
"type": "I/SigI",
"value": 0.83
},
{
"type": "CC(1/2)",
"value": 0.27
}
]
}
]
}