Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f300e1aa1d2f476d9dbdef0a4dbe8158",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.150,
"b": 88.150,
"c": 39.023,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91188],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [88.160,1.050],
"number_observations": 725161,
"number_observations_unique": 138527,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 5.500
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.070,1.050],
"number_observations": 13397,
"number_observations_unique": 6006,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.781
},
{
"type": "R(meas)",
"value": 2.273
},
{
"type": "R(pim)",
"value": 1.384
},
{
"type": "I/SigI",
"value": 0.200
},
{
"type": "Completeness",
"value": 85.100
},
{
"type": "Redundancy",
"value": 2.200
},
{
"type": "CC(1/2)",
"value": 0.289
}
]
},
{
"resolution_limits": [88.160,5.660],
"number_observations": 6539,
"number_observations_unique": 973,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 20.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}