Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "72baae153760499859506627ef5ad2c0",
"space_group_name": "I 4 2 2",
"unit_cell": {
"a": 96.07,
"b": 96.07,
"c": 159.96,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.8170,2.800],
"number_observations": 113166,
"number_observations_unique": 9601,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 12.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 11.700
}
]
},
"refln_shells": [
{
"resolution_limits": [2.900,2.800],
"number_observations": 11380,
"number_observations_unique": 950,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.487
},
{
"type": "I/SigI",
"value": 2.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.820
}
]
},
{
"resolution_limits": [3.020,2.900],
"number_observations": 11190,
"number_observations_unique": 938,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.380
},
{
"type": "I/SigI",
"value": 3.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.830
}
]
},
{
"resolution_limits": [3.150,3.020],
"number_observations": 11118,
"number_observations_unique": 928,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.315
},
{
"type": "I/SigI",
"value": 4.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.910
}
]
},
{
"resolution_limits": [3.320,3.150],
"number_observations": 11354,
"number_observations_unique": 946,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.264
},
{
"type": "I/SigI",
"value": 5.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.900
}
]
},
{
"resolution_limits": [3.530,3.320],
"number_observations": 11346,
"number_observations_unique": 945,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.195
},
{
"type": "I/SigI",
"value": 6.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.890
}
]
},
{
"resolution_limits": [3.800,3.530],
"number_observations": 11211,
"number_observations_unique": 942,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "I/SigI",
"value": 9.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.860
}
]
},
{
"resolution_limits": [4.180,3.800],
"number_observations": 11542,
"number_observations_unique": 966,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "I/SigI",
"value": 13.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.870
}
]
},
{
"resolution_limits": [4.790,4.180],
"number_observations": 11364,
"number_observations_unique": 965,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 19.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.730
}
]
},
{
"resolution_limits": [6.030,4.790],
"number_observations": 11242,
"number_observations_unique": 976,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 22.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.480
}
]
},
{
"resolution_limits": [67.930,6.030],
"number_observations": 11419,
"number_observations_unique": 1045,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 39.100
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 10.790
}
]
}
]
}