Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0667a4ab76211813d4e318b27437f5f5",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 32.83,
"b": 72.21,
"c": 79.82,
"alpha": 90.00,
"beta": 91.53,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.11,1.19],
"number_observations_unique": 115537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 8.6
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
},
"refln_shells": [
{
"resolution_limits": [1.21,1.19],
"number_observations_unique": 5760,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.47
},
{
"type": "R(meas)",
"value": 0.56
},
{
"type": "R(pim)",
"value": 0.29
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.64
}
]
}
]
}