Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7208fce1e2b19e7f5c6f82411a6bc42a",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 82.16,
"b": 82.16,
"c": 134.25,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.280,2.290],
"number_observations": 478579,
"number_observations_unique": 24256,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "R(meas)",
"value": 0.162
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 15.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.350,2.290],
"number_observations": 37213,
"number_observations_unique": 1758,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.407
},
{
"type": "R(meas)",
"value": 2.465
},
{
"type": "R(pim)",
"value": 0.533
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.200
},
{
"type": "CC(1/2)",
"value": 0.699
}
]
},
{
"resolution_limits": [39.280,10.240],
"number_observations": 4227,
"number_observations_unique": 315,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 37.500
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 13.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}