Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b2a8b7dabed31571da34aaf3cfa676bb",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 104.27,
"b": 57.69,
"c": 92.51,
"alpha": 90.00,
"beta": 121.71,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.76,2.28],
"number_observations": 143086,
"number_observations_unique": 21073,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.101
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 11.5
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.34,2.28],
"number_observations": 9675,
"number_observations_unique": 1528,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.211
},
{
"type": "R(pim)",
"value": 0.523
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.730
}
]
}
]
}