Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a9966246d22ffbc71d357f48cc4a2a2c",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 84.347,
"b": 84.347,
"c": 45.735,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.740,1.450],
"number_observations": 768780,
"number_observations_unique": 29690,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(meas)",
"value": 0.089
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 25.000
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 25.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.470,1.450],
"number_observations": 17765,
"number_observations_unique": 1314,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.461
},
{
"type": "R(meas)",
"value": 1.519
},
{
"type": "R(pim)",
"value": 0.409
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 92.900
},
{
"type": "Redundancy",
"value": 13.500
},
{
"type": "CC(1/2)",
"value": 0.552
}
]
},
{
"resolution_limits": [45.740,7.940],
"number_observations": 4921,
"number_observations_unique": 233,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 76.000
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 21.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}