Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "58fbb0315bd38b3145ccf6ac2bdb6c1a",
"space_group_name": "P 1",
"unit_cell": {
"a": 48.577,
"b": 59.461,
"c": 80.404,
"alpha": 79.39,
"beta": 82.31,
"gamma": 76.19
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.960,1.660],
"number_observations": 155480,
"number_observations_unique": 88015,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 7.500
},
{
"type": "Completeness",
"value": 87.700
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.660],
"number_observations": 23708,
"number_observations_unique": 13924,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.245
},
{
"type": "R(meas)",
"value": 1.761
},
{
"type": "R(pim)",
"value": 1.245
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 94.800
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.389
}
]
},
{
"resolution_limits": [46.960,5.260],
"number_observations": 5172,
"number_observations_unique": 2929,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 22.300
},
{
"type": "Completeness",
"value": 92.100
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}