Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "905360861ef3a437db7d783b7455e8dc",
"space_group_name": "F 4 3 2",
"unit_cell": {
"a": 177.26,
"b": 177.26,
"c": 177.26,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97953],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.450,1.760],
"number_observations_unique": 23392,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 15.600
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.800,1.760],
"number_observations_unique": 1299,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.731
},
{
"type": "R(meas)",
"value": 0.854
},
{
"type": "R(pim)",
"value": 0.428
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.585
}
]
},
{
"resolution_limits": [53.450,8.980],
"number_observations_unique": 209,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Completeness",
"value": 91.800
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}