Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "faf8026cdb351a4e46dcf4e908fef703",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 55.15,
"b": 83.28,
"c": 218.94,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.250,2.600],
"number_observations": 224741,
"number_observations_unique": 30616,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.187
},
{
"type": "R(meas)",
"value": 0.200
},
{
"type": "R(pim)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 7.300
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [2.720,2.600],
"number_observations": 25000,
"number_observations_unique": 3423,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.170
},
{
"type": "R(meas)",
"value": 1.252
},
{
"type": "R(pim)",
"value": 0.431
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 90.300
},
{
"type": "Redundancy",
"value": 7.300
},
{
"type": "CC(1/2)",
"value": 0.735
}
]
},
{
"resolution_limits": [49.250,9.010],
"number_observations": 6198,
"number_observations_unique": 886,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 14.500
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}