Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f975887a44ebaf7d3d73d60f3af6fb91",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 45.07,
"b": 204.50,
"c": 239.32,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.291,2.90],
"number_observations_unique": 40478,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.168
},
{
"type": "R(meas)",
"value": 0.194
},
{
"type": "R(pim)",
"value": 0.094
},
{
"type": "I/SigI",
"value": 7.2
},
{
"type": "Completeness",
"value": 80.0
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [3.005,2.90],
"number_observations_unique": 2024,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.745
},
{
"type": "R(meas)",
"value": 0.860
},
{
"type": "R(pim)",
"value": 0.421
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 40.0
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.795
}
]
}
]
}