Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b43e3ca4bcee987bca1f98b01dcaba08",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 60.115,
"b": 60.115,
"c": 161.067,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.170,2.200],
"number_observations": 195859,
"number_observations_unique": 15845,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 17.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.200],
"number_observations": 16993,
"number_observations_unique": 1332,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.340
},
{
"type": "R(meas)",
"value": 1.395
},
{
"type": "R(pim)",
"value": 0.387
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.800
},
{
"type": "CC(1/2)",
"value": 0.920
}
]
},
{
"resolution_limits": [48.170,9.070],
"number_observations": 2852,
"number_observations_unique": 296,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 63.300
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 9.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}