Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7ac28d80b7c98d36decdb637bb331b64",
"space_group_name": "P 1",
"unit_cell": {
"a": 51.798,
"b": 60.872,
"c": 101.718,
"alpha": 76.56,
"beta": 75.59,
"gamma": 79.39
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.500,1.900],
"number_observations_unique": 91396,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 91.600
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.900],
"number_observations_unique": 4556,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.955
},
{
"type": "R(meas)",
"value": 1.106
},
{
"type": "R(pim)",
"value": 0.557
},
{
"type": "Completeness",
"value": 91.200
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.629
}
]
},
{
"resolution_limits": [41.500,9.870],
"number_observations_unique": 572,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "Completeness",
"value": 87.900
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}