Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "339aae37305b8348d94d17ddf6e04551",
"space_group_name": "P 1",
"unit_cell": {
"a": 55.96,
"b": 72.65,
"c": 90.73,
"alpha": 109.11,
"beta": 91.28,
"gamma": 91.20
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.310,1.430],
"number_observations": 436754,
"number_observations_unique": 222272,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 11.500
},
{
"type": "Completeness",
"value": 89.100
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.470,1.430],
"number_observations_unique": 11276,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.779
},
{
"type": "R(meas)",
"value": 1.101
},
{
"type": "R(pim)",
"value": 0.779
},
{
"type": "Completeness",
"value": 60.900
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.492
}
]
},
{
"resolution_limits": [34.310,6.400],
"number_observations_unique": 2533,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.020
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "Completeness",
"value": 90.700
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}