Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "01c7b65450acaee91ecee8cea31ecb39",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.32,
"b": 95.32,
"c": 45.72,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.180,1.280],
"number_observations": 568224,
"number_observations_unique": 51319,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 19.100
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 11.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.310,1.280],
"number_observations": 12269,
"number_observations_unique": 3051,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.189
},
{
"type": "R(meas)",
"value": 1.371
},
{
"type": "R(pim)",
"value": 0.652
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 77.800
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 0.357
}
]
},
{
"resolution_limits": [31.180,5.720],
"number_observations": 7962,
"number_observations_unique": 625,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 67.400
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 12.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}