Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "6ec3fce9c65f170fcb7943c5361ac9c5",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 48.938,
"b": 48.938,
"c": 195.364,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.84,1.74],
"number_observations_unique": 29128,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 18.4
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 10.4
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [48.84,9.03],
"number_observations_unique": 277,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 49.8
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 8.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.77,1.74],
"number_observations_unique": 1524,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.467
},
{
"type": "R(meas)",
"value": 1.625
},
{
"type": "R(pim)",
"value": 0.688
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 10.3
},
{
"type": "CC(1/2)",
"value": 0.603
}
]
}
]
}