Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "2f3959740de35ed68c8d1745c5047fff",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.633,
"b": 88.633,
"c": 39.443,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.320,1.000],
"number_observations": 1033239,
"number_observations_unique": 164319,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 9.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.020,1.000],
"number_observations": 33085,
"number_observations_unique": 7298,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.962
},
{
"type": "R(meas)",
"value": 2.213
},
{
"type": "R(pim)",
"value": 0.996
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 90.100
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 0.376
}
]
},
{
"resolution_limits": [44.320,5.480],
"number_observations": 7411,
"number_observations_unique": 1090,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 36.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}