Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3d7201d78ccee36817b16a0ac33447a5",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 36.061,
"b": 67.087,
"c": 38.662,
"alpha": 90.000,
"beta": 101.218,
"gamma": 90.000
},
"wavelengths": [0.97933],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.923,1.055],
"number_observations_unique": 78970,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 15.03
},
{
"type": "Completeness",
"value": 95.5
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.073,1.055],
"number_observations_unique": 2430,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.461
},
{
"type": "R(meas)",
"value": 0.558
},
{
"type": "R(pim)",
"value": 0.307
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 59.6
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}