Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5d41d7b1156cd11fecd580e640537005",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.065,
"b": 53.573,
"c": 44.396,
"alpha": 90.00,
"beta": 100.95,
"gamma": 90.00
},
"wavelengths": [0.91258],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [56.00,1.40],
"number_observations": 136341,
"number_observations_unique": 50624,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 7.5
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.42,1.40],
"number_observations": 3693,
"number_observations_unique": 2249,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.069
},
{
"type": "R(meas)",
"value": 1.451
},
{
"type": "R(pim)",
"value": 0.974
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 1.6
},
{
"type": "CC(1/2)",
"value": 0.360
}
]
}
]
}