Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7c8fb3c82795e5285c8af80ccdaf6b67",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.496,
"b": 53.274,
"c": 44.980,
"alpha": 90.00,
"beta": 101.99,
"gamma": 90.00
},
"wavelengths": [0.91264],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.52,1.74],
"number_observations": 87038,
"number_observations_unique": 27002,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 16.3
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.77,1.74],
"number_observations": 4579,
"number_observations_unique": 1411,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.900
},
{
"type": "R(meas)",
"value": 2.284
},
{
"type": "R(pim)",
"value": 1.253
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.271
}
]
}
]
}