Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d4fbfd10d29a236a6f7f5ac7cc787a56",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 86.519,
"b": 57.700,
"c": 94.098,
"alpha": 90.00,
"beta": 115.51,
"gamma": 90.00
},
"wavelengths": [1.27951],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.850,2.350],
"number_observations": 287546,
"number_observations_unique": 35217,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "R(meas)",
"value": 0.129
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 10.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 8.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.440,2.350],
"number_observations_unique": 3633,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.201
},
{
"type": "R(meas)",
"value": 2.349
},
{
"type": "R(pim)",
"value": 0.806
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 8.200
},
{
"type": "CC(1/2)",
"value": 0.387
}
]
},
{
"resolution_limits": [28.850,8.790],
"number_observations_unique": 702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 7.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}