Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8818caf3309dc5ee99d9b66117abc977",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.188,
"b": 64.874,
"c": 76.502,
"alpha": 90.000,
"beta": 93.789,
"gamma": 90.000
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.2,1.6],
"number_observations_unique": 62014,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.0623
},
{
"type": "R(pim)",
"value": 0.02555
},
{
"type": "I/SigI",
"value": 17.56
},
{
"type": "Completeness",
"value": 94.89
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.65,1.6],
"number_observations_unique": 4725,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.001
},
{
"type": "R(pim)",
"value": 0.4238
},
{
"type": "Completeness",
"value": 72.97
},
{
"type": "Redundancy",
"value": 1.40
},
{
"type": "CC(1/2)",
"value": 0.631
}
]
}
]
}