Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dd098bc29f0bca5884bc9c3595347484",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 87.053,
"b": 57.689,
"c": 32.509,
"alpha": 90.0,
"beta": 91.7,
"gamma": 90.0
},
"wavelengths": [0.94055],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.08,1.28],
"number_observations": 276668,
"number_observations_unique": 39249,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "R(meas)",
"value": 0.172
},
{
"type": "R(pim)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 94.9
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [1.30,1.28],
"number_observations": 13322,
"number_observations_unique": 1909,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.746
},
{
"type": "R(meas)",
"value": 2.968
},
{
"type": "R(pim)",
"value": 1.114
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.673
}
]
}
]
}