Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c01cd0d01b66b51c17f0c314ef4ff187",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 80.36,
"b": 80.36,
"c": 139.56,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.590,1.470],
"number_observations": 888251,
"number_observations_unique": 46059,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 17.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.510,1.470],
"number_observations": 60087,
"number_observations_unique": 3334,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.553
},
{
"type": "R(meas)",
"value": 2.627
},
{
"type": "R(pim)",
"value": 0.615
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.000
},
{
"type": "CC(1/2)",
"value": 0.532
}
]
},
{
"resolution_limits": [69.590,6.570],
"number_observations": 11126,
"number_observations_unique": 649,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 71.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}