Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9e5167c166291ef3dcf8d41912e9534c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 36.064,
"b": 79.549,
"c": 42.891,
"alpha": 90.00,
"beta": 108.28,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.05],
"number_observations_unique": 97955,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 23.85
},
{
"type": "Completeness",
"value": 91.4
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.07,1.05],
"number_observations_unique": 3838,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.352
},
{
"type": "R(pim)",
"value": 0.137
},
{
"type": "I/SigI",
"value": 5.24
},
{
"type": "Completeness",
"value": 71.9
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.942
}
]
}
]
}