Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d0663f85e32e8ca0e37cbb076aab57b5",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 66.12,
"b": 89.56,
"c": 100.29,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.780,1.380],
"number_observations": 659026,
"number_observations_unique": 60388,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 25.100
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 10.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.420,1.380],
"number_observations": 17121,
"number_observations_unique": 3941,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.671
},
{
"type": "R(meas)",
"value": 0.762
},
{
"type": "R(pim)",
"value": 0.349
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 87.900
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.716
}
]
},
{
"resolution_limits": [34.780,6.170],
"number_observations": 8641,
"number_observations_unique": 755,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 56.200
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 11.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}