Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8705896376153a3d9a0f2b8e75bd5962",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.915,
"b": 88.915,
"c": 39.702,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.460,1.020],
"number_observations": 1009566,
"number_observations_unique": 157671,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 9.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.040,1.020],
"number_observations": 41304,
"number_observations_unique": 7641,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.429
},
{
"type": "R(meas)",
"value": 2.687
},
{
"type": "R(pim)",
"value": 1.130
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.366
}
]
},
{
"resolution_limits": [44.460,5.590],
"number_observations": 7065,
"number_observations_unique": 1047,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 36.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}