Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "917913bcefd059625338907e3c82801c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 69.461,
"b": 56.076,
"c": 71.360,
"alpha": 90.0,
"beta": 98.4,
"gamma": 90.0
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.590,2.730],
"number_observations": 92266,
"number_observations_unique": 14516,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.195
},
{
"type": "R(meas)",
"value": 0.212
},
{
"type": "R(pim)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 5.400
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.860,2.730],
"number_observations": 8473,
"number_observations_unique": 1756,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.210
},
{
"type": "R(meas)",
"value": 1.357
},
{
"type": "R(pim)",
"value": 0.599
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 91.400
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.825
}
]
},
{
"resolution_limits": [70.590,9.050],
"number_observations": 2561,
"number_observations_unique": 432,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 13.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}