Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "266c1d183202eee238fe51400c5f356a",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 59.539,
"b": 59.539,
"c": 161.798,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97857],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.950,1.800],
"number_observations": 343175,
"number_observations_unique": 27983,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 17.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.840,1.800],
"number_observations": 20848,
"number_observations_unique": 1605,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.454
},
{
"type": "R(meas)",
"value": 2.554
},
{
"type": "R(pim)",
"value": 0.704
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.000
},
{
"type": "CC(1/2)",
"value": 0.563
}
]
},
{
"resolution_limits": [47.950,9.000],
"number_observations": 2987,
"number_observations_unique": 299,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 53.000
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 10.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}