Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "439004c5a826e1e02e5c2b0901e63b0d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.123,
"b": 70.131,
"c": 61.100,
"alpha": 90.00,
"beta": 96.31,
"gamma": 90.00
},
"wavelengths": [1.12700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.594,1.798],
"number_observations_unique": 38844,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1052
},
{
"type": "R(meas)",
"value": 0.1234
},
{
"type": "R(pim)",
"value": 0.06394
},
{
"type": "I/SigI",
"value": 12.58
},
{
"type": "Completeness",
"value": 98.78
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.863,1.798],
"number_observations_unique": 3808,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.7413
},
{
"type": "R(meas)",
"value": 0.8709
},
{
"type": "R(pim)",
"value": 0.4528
},
{
"type": "I/SigI",
"value": 1.61
},
{
"type": "Completeness",
"value": 97.64
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.644
}
]
}
]
}