Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "61caed3779deea8718cfcfc04d34c70b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.717,
"b": 57.244,
"c": 64.877,
"alpha": 90.00,
"beta": 94.77,
"gamma": 90.00
},
"wavelengths": [0.92201],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.26,1.27],
"number_observations": 440729,
"number_observations_unique": 71672,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 18.8
},
{
"type": "Completeness",
"value": 86.1
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.29,1.27],
"number_observations": 5369,
"number_observations_unique": 1521,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.252
},
{
"type": "R(meas)",
"value": 1.478
},
{
"type": "R(pim)",
"value": 0.776
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.400
}
]
}
]
}