Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b94b91d64cfbd15a8e379a6722701f12",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.183,
"b": 53.418,
"c": 44.335,
"alpha": 90.00,
"beta": 101.54,
"gamma": 90.00
},
"wavelengths": [0.91264],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.46,1.69],
"number_observations": 91454,
"number_observations_unique": 29085,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 14.0
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.72,1.69],
"number_observations": 4459,
"number_observations_unique": 1377,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.115
},
{
"type": "R(meas)",
"value": 1.343
},
{
"type": "R(pim)",
"value": 0.738
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.338
}
]
}
]
}