Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f74e416aff2ca84699a36c8d89ca3ef6",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 92.622,
"b": 58.256,
"c": 154.789,
"alpha": 90.00,
"beta": 91.26,
"gamma": 90.00
},
"wavelengths": [0.97857],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.310,1.870],
"number_observations": 507596,
"number_observations_unique": 68387,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.159
},
{
"type": "R(meas)",
"value": 0.171
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 7.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.400
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.910,1.870],
"number_observations": 33696,
"number_observations_unique": 4360,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.219
},
{
"type": "R(meas)",
"value": 1.307
},
{
"type": "R(pim)",
"value": 0.467
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.700
},
{
"type": "CC(1/2)",
"value": 0.665
}
]
},
{
"resolution_limits": [49.310,8.970],
"number_observations": 4649,
"number_observations_unique": 667,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 19.800
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}