Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "910fcde72acc8791cd7cd4a3d72187f1",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 61.014,
"b": 91.260,
"c": 24.126,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.930,1.630],
"number_observations": 112903,
"number_observations_unique": 16909,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 28.300
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.670,1.630],
"number_observations": 6848,
"number_observations_unique": 1079,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.839
},
{
"type": "R(pim)",
"value": 0.357
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 88.400
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.727
}
]
},
{
"resolution_limits": [28.930,7.290],
"number_observations": 1333,
"number_observations_unique": 239,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 84.300
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}