Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "04705ecbc69c51c8a5a9aad16d12f4eb",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 167.540,
"b": 223.101,
"c": 195.002,
"alpha": 90.00,
"beta": 100.38,
"gamma": 90.00
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.22,3.60],
"number_observations": 622175,
"number_observations_unique": 81363,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.559
},
{
"type": "R(meas)",
"value": 0.600
},
{
"type": "R(pim)",
"value": 0.216
},
{
"type": "I/SigI",
"value": 4.4
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.6
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [3.67,3.60],
"number_observations": 34496,
"number_observations_unique": 4489,
"quality_factors": [
{
"type": "R(merge)",
"value": 8.839
},
{
"type": "R(meas)",
"value": 9.478
},
{
"type": "R(pim)",
"value": 3.413
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 7.7
},
{
"type": "CC(1/2)",
"value": 0.236
}
]
}
]
}