Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6c1d8628796f707f7a2efd1d54e73df0",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.49,
"b": 56.44,
"c": 64.60,
"alpha": 90.00,
"beta": 94.45,
"gamma": 90.00
},
"wavelengths": [0.94055],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.88,1.37],
"number_observations": 441787,
"number_observations_unique": 64705,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 11.5
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.41,1.37],
"number_observations": 28790,
"number_observations_unique": 4755,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.417
},
{
"type": "R(meas)",
"value": 2.646
},
{
"type": "R(pim)",
"value": 1.057
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.256
}
]
}
]
}