Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "bbe3c4f86b2bc1d0a20db03213f5d028",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 38.010,
"b": 75.932,
"c": 56.301,
"alpha": 90.00,
"beta": 97.28,
"gamma": 90.00
},
"wavelengths": [0.87310],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.99,2.80],
"number_observations": 42350,
"number_observations_unique": 7337,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.439
},
{
"type": "R(meas)",
"value": 0.496
},
{
"type": "R(pim)",
"value": 0.225
},
{
"type": "I/SigI",
"value": 6.0
},
{
"type": "Completeness",
"value": 93.1
},
{
"type": "Redundancy",
"value": 5.8
},
{
"type": "CC(1/2)",
"value": 0.789
}
]
},
"refln_shells": [
{
"resolution_limits": [2.95,2.80],
"number_observations": 6741,
"number_observations_unique": 1137,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.396
},
{
"type": "R(meas)",
"value": 3.800
},
{
"type": "R(pim)",
"value": 1.661
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.207
}
]
}
]
}