Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1b5b72f238cf94f7ca760391de2d32f7",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 43.137,
"b": 111.959,
"c": 62.505,
"alpha": 90.00,
"beta": 90.99,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [62.496,1.984],
"number_observations": 132792,
"number_observations_unique": 40459,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.153
},
{
"type": "R(meas)",
"value": 0.182
},
{
"type": "R(pim)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 6.700
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.982
}
]
},
"refln_shells": [
{
"resolution_limits": [1.991,1.984],
"number_observations": 15371,
"number_observations_unique": 5743,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.570
},
{
"type": "R(meas)",
"value": 0.662
},
{
"type": "R(pim)",
"value": 0.373
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 91.700
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.512
}
]
}
]
}