Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "948b755f9ee858cb53e4504226573280",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 65.84,
"b": 89.63,
"c": 100.49,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.760,1.890],
"number_observations": 252619,
"number_observations_unique": 23883,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 24.100
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.890],
"number_observations": 8644,
"number_observations_unique": 1533,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.464
},
{
"type": "R(meas)",
"value": 0.513
},
{
"type": "R(pim)",
"value": 0.211
},
{
"type": "I/SigI",
"value": 5.000
},
{
"type": "Completeness",
"value": 87.900
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.902
}
]
},
{
"resolution_limits": [34.760,8.450],
"number_observations": 2936,
"number_observations_unique": 298,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 42.200
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 9.900
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}