Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9ab75788da0dbd3e5e0a28c0419c63f6",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 77.443,
"b": 79.817,
"c": 147.089,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98011],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.030,1.900],
"number_observations": 1009308,
"number_observations_unique": 71625,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "R(meas)",
"value": 0.142
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 14.600
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 14.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.900],
"number_observations_unique": 3952,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.802
},
{
"type": "R(meas)",
"value": 2.933
},
{
"type": "R(pim)",
"value": 0.845
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 86.800
},
{
"type": "Redundancy",
"value": 11.400
},
{
"type": "CC(1/2)",
"value": 0.369
}
]
},
{
"resolution_limits": [49.030,9.110],
"number_observations_unique": 712,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 62.0
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}