Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "d5de0bf657d1cc04cf91b5fcb70c3857",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 54.946,
"b": 98.931,
"c": 58.507,
"alpha": 90.00,
"beta": 107.52,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.47,1.87],
"number_observations": 332914,
"number_observations_unique": 49230,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 11.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.91,1.87],
"number_observations": 21360,
"number_observations_unique": 3144,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.242
},
{
"type": "R(meas)",
"value": 1.345
},
{
"type": "R(pim)",
"value": 0.513
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.732
}
]
}
]
}