Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "be4133720435c74ce9cc96082eed6802",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 79.969,
"b": 79.969,
"c": 92.073,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.370,1.690],
"number_observations": 857699,
"number_observations_unique": 34140,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 19.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.730,1.690],
"number_observations": 41424,
"number_observations_unique": 2485,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.811
},
{
"type": "R(meas)",
"value": 2.899
},
{
"type": "R(pim)",
"value": 0.699
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.700
},
{
"type": "CC(1/2)",
"value": 0.488
}
]
},
{
"resolution_limits": [60.370,7.560],
"number_observations": 10613,
"number_observations_unique": 471,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 85.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}