Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b7839722fe55148a94747a8140808868",
"space_group_name": "P 1",
"unit_cell": {
"a": 39.586,
"b": 45.531,
"c": 53.473,
"alpha": 73.20,
"beta": 79.99,
"gamma": 69.64
},
"wavelengths": [0.70542],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.020,1.278],
"number_observations_unique": 44163,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 8.0
},
{
"type": "Completeness",
"value": 87.0
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.544,1.278],
"number_observations_unique": 2208,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.614
},
{
"type": "R(pim)",
"value": 0.614
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.592
}
]
}
]
}