Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0e265880c118e9faf20fc87b54a4e182",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 39.302,
"b": 67.869,
"c": 40.101,
"alpha": 90.00,
"beta": 93.53,
"gamma": 90.00
},
"wavelengths": [0.96832],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.03,1.20],
"number_observations_unique": 65452,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 18.5
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations_unique": 3155,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.462
},
{
"type": "R(meas)",
"value": 0.515
},
{
"type": "R(pim)",
"value": 0.220
},
{
"type": "I/SigI",
"value": 3.9
},
{
"type": "Completeness",
"value": 96.7
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.820
}
]
}
]
}