Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "aecb2ffd4d77c5677a83cafff3206168",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 115.393,
"b": 52.306,
"c": 120.402,
"alpha": 90.0,
"beta": 92.5,
"gamma": 90.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [120.29,1.62],
"number_observations": 562301,
"number_observations_unique": 91411,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "R(meas)",
"value": 0.111
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.66,1.62],
"number_observations": 42349,
"number_observations_unique": 6729,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.308
},
{
"type": "R(meas)",
"value": 1.426
},
{
"type": "R(pim)",
"value": 0.560
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.787
}
]
}
]
}